N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide

C18H27N5O — CID 95351614

IUPACN-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide
SMILESCc1nc2n(n1)C[C@@H](NCC(=O)N(C1=CCCCC1)C1CC1)CC2
InChIInChI=1S/C18H27N5O/c1-13-20-17-10-7-14(12-22(17)21-13)19-11-18(24)23(16-8-9-16)15-5-3-2-4-6-15/h5,14,16,19H,2-4,6-12H2,1H3/t14-/m0/s1
InChIKeyJSLXGQLODDPBEJ-AWEZNQCLSA-N
MW329.45 g/mol
LogP1.94
Rot. Bonds5

About N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide

N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide (PubChem CID 95351614) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide
PubChem CID95351614
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC NameN-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide
SMILESCc1nc2n(n1)C[C@@H](NCC(=O)N(C1=CCCCC1)C1CC1)CC2
InChIInChI=1S/C18H27N5O/c1-13-20-17-10-7-14(12-22(17)21-13)19-11-18(24)23(16-8-9-16)15-5-3-2-4-6-15/h5,14,16,19H,2-4,6-12H2,1H3/t14-/m0/s1
InChIKeyJSLXGQLODDPBEJ-AWEZNQCLSA-N
XLogP1.94
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide with MolForge

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Related Compounds

N-(cyclohexen-1-yl)-N-ethyl-2-[[(6R)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide
CID 95338999
1-[[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]methyl]cyclohexan-1-ol
CID 95310254
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide
CID 95344349
2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]amino]pentanoic acid
CID 43631867
(2S)-N-methyl-1-[2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetyl]pyrrolidine-2-carboxamide
CID 95979274
1-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-[[(6R)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]ethanone
CID 95612124
2-methyl-N-(2-methylpropyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 115616214
2-bromo-N-(cyclohexen-1-yl)-N-cyclopropylacetamide
CID 81222527
3-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]amino]propanoic acid
CID 43466450
N-(cyclohexen-1-yl)-N-cyclopropyl-2-(3,5-dimethylpiperazin-1-yl)acetamide
CID 63874630
4-[2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetyl]piperazin-2-one
CID 95758132
ethyl 4-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]piperazine-1-carboxylate
CID 51110425

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide?
The IUPAC name of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide (CID 95351614) is N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide.
What is the SMILES notation for N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide?
The canonical SMILES for N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide is Cc1nc2n(n1)C[C@@H](NCC(=O)N(C1=CCCCC1)C1CC1)CC2.
What is the InChIKey of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide?
The InChIKey is JSLXGQLODDPBEJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H27N5O/c1-13-20-17-10-7-14(12-22(17)21-13)19-11-18(24)23(16-8-9-16)15-5-3-2-4-6-15/h5,14,16,19H,2-4,6-12H2,1H3/t14-/m0/s1.
What are the key properties of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide?
N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide has a molecular weight of 329.45 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]acetamide is sourced from PubChem (CID 95351614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).