N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide

C15H30N2O2 — CID 75501744

IUPACN-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide
SMILESCC1CCCC(NC(=O)CN[C@H](CO)C(C)C)C1C
InChIInChI=1S/C15H30N2O2/c1-10(2)14(9-18)16-8-15(19)17-13-7-5-6-11(3)12(13)4/h10-14,16,18H,5-9H2,1-4H3,(H,17,19)/t11?,12?,13?,14-/m1/s1
InChIKeyNVUJHFTZFMPWQP-SLDMJWGPSA-N
MW270.42 g/mol
LogP1.53
Rot. Bonds6

About N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide

N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide (PubChem CID 75501744) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide
PubChem CID75501744
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide
SMILESCC1CCCC(NC(=O)CN[C@H](CO)C(C)C)C1C
InChIInChI=1S/C15H30N2O2/c1-10(2)14(9-18)16-8-15(19)17-13-7-5-6-11(3)12(13)4/h10-14,16,18H,5-9H2,1-4H3,(H,17,19)/t11?,12?,13?,14-/m1/s1
InChIKeyNVUJHFTZFMPWQP-SLDMJWGPSA-N
XLogP1.53
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylcyclohexyl)-2-(propan-2-ylamino)acetamide
CID 60648714
methyl N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]carbamate
CID 47303429
N-(2,3-dimethylcyclohexyl)-2-(prop-2-enylamino)acetamide
CID 78908844
(2S)-2-amino-N-(2,3-dimethylcyclohexyl)-3-methylbutanamide
CID 61148874
N-(2,3-dimethylcyclohexyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide
CID 111860060
5-[[(1S,2S,3R)-2,3-dimethylcyclohexyl]amino]-5-oxopentanoic acid
CID 7317755
N-(2,3-dimethylcyclopentyl)-3-(propan-2-ylamino)propanamide
CID 64907400
tert-butyl 4-[(2,3-dimethylcyclohexyl)amino]-4-oxobutanoate
CID 106706973
3-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]sulfanyl-2-methylpropanoic acid
CID 64916472
2-(tert-butylamino)-N-(2-methylcyclopentyl)acetamide
CID 78942036
2-azido-N-(2,3-dimethylcyclohexyl)acetamide
CID 61374962
N-(2,3-dimethylcyclohexyl)tridecanamide
CID 57307251

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide?
The IUPAC name of N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide (CID 75501744) is N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide.
What is the SMILES notation for N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide?
The canonical SMILES for N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide is CC1CCCC(NC(=O)CN[C@H](CO)C(C)C)C1C.
What is the InChIKey of N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide?
The InChIKey is NVUJHFTZFMPWQP-SLDMJWGPSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-10(2)14(9-18)16-8-15(19)17-13-7-5-6-11(3)12(13)4/h10-14,16,18H,5-9H2,1-4H3,(H,17,19)/t11?,12?,13?,14-/m1/s1.
What are the key properties of N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide?
N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide has a molecular weight of 270.42 g/mol, XLogP of 1.53, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclohexyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide is sourced from PubChem (CID 75501744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).