N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide

C19H33N7O — CID 129401911

IUPACN-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide
SMILESC[C@H](c1nnnn1C1CC1)N1CCN(CC(=O)N(C)C2CCCCC2)CC1
InChIInChI=1S/C19H33N7O/c1-15(19-20-21-22-26(19)17-8-9-17)25-12-10-24(11-13-25)14-18(27)23(2)16-6-4-3-5-7-16/h15-17H,3-14H2,1-2H3/t15-/m1/s1
InChIKeyCJJKXPCAPVKIBQ-OAHLLOKOSA-N
MW375.52 g/mol
LogP1.48
Rot. Bonds6

About N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide

N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide (PubChem CID 129401911) has the molecular formula C19H33N7O and a molecular weight of 375.52 g/mol. Its IUPAC name is N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide
PubChem CID129401911
Molecular FormulaC19H33N7O
Molecular Weight375.52 g/mol
Exact Mass375.27
IUPAC NameN-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide
SMILESC[C@H](c1nnnn1C1CC1)N1CCN(CC(=O)N(C)C2CCCCC2)CC1
InChIInChI=1S/C19H33N7O/c1-15(19-20-21-22-26(19)17-8-9-17)25-12-10-24(11-13-25)14-18(27)23(2)16-6-4-3-5-7-16/h15-17H,3-14H2,1-2H3/t15-/m1/s1
InChIKeyCJJKXPCAPVKIBQ-OAHLLOKOSA-N
XLogP1.48
TPSA70.39 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.52
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide with MolForge

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Related Compounds

N-cyclohexyl-N-methyl-2-[4-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]acetamide
CID 95158985
2-[4-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]piperazin-1-yl]acetic acid
CID 43521865
N-cyclohexyl-2-[4-(1-hydroxybutan-2-yl)piperazin-1-yl]-N-methylacetamide
CID 111489805
2-[(2R)-4-[(1S)-1-(1-cyclohexyltetrazol-5-yl)ethyl]-2-methylpiperazin-1-yl]ethanol
CID 124864640
N-cyclohexyl-2-[4-(2-hydroxybutyl)piperazin-1-yl]-N-methylacetamide
CID 111106282
2-[4-[(2S)-2-amino-4-methylpentanoyl]piperazin-1-yl]-N-cyclohexyl-N-methylacetamide;dihydrochloride
CID 119876752
N,N-dimethyl-2-[4-[1-(1-phenyltetrazol-5-yl)ethyl]piperazin-1-yl]acetamide
CID 51086676
N,N-dimethyl-2-[4-[(1R)-1-(1-phenyltetrazol-5-yl)ethyl]piperazin-1-yl]acetamide
CID 94399883
2-[4-[(1-cyclopropyltetrazol-5-yl)methyl]piperazin-1-yl]-N,N-dimethylacetamide
CID 37268796
N-cyclohexyl-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
CID 78782354
1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]-4-[(1-methylpyrazol-4-yl)methyl]-1,4-diazepane
CID 124623662
2-[4-(1-aminopropan-2-yl)piperazin-1-yl]-N-cyclopropyl-N-methylacetamide
CID 63339686

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide?
The IUPAC name of N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide (CID 129401911) is N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide.
What is the SMILES notation for N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide?
The canonical SMILES for N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide is C[C@H](c1nnnn1C1CC1)N1CCN(CC(=O)N(C)C2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide?
The InChIKey is CJJKXPCAPVKIBQ-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H33N7O/c1-15(19-20-21-22-26(19)17-8-9-17)25-12-10-24(11-13-25)14-18(27)23(2)16-6-4-3-5-7-16/h15-17H,3-14H2,1-2H3/t15-/m1/s1.
What are the key properties of N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide?
N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide has a molecular weight of 375.52 g/mol, XLogP of 1.48, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide is sourced from PubChem (CID 129401911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).