2-azido-N-(2,3-dimethylcyclohexyl)acetamide

C10H18N4O — CID 61374962

IUPAC2-azido-N-(2,3-dimethylcyclohexyl)acetamide
SMILESCC1CCCC(NC(=O)CN=[N+]=[N-])C1C
InChIInChI=1S/C10H18N4O/c1-7-4-3-5-9(8(7)2)13-10(15)6-12-14-11/h7-9H,3-6H2,1-2H3,(H,13,15)
InChIKeySNIZQZUTYYPIOA-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.24
Rot. Bonds3

About 2-azido-N-(2,3-dimethylcyclohexyl)acetamide

2-azido-N-(2,3-dimethylcyclohexyl)acetamide (PubChem CID 61374962) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-azido-N-(2,3-dimethylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-azido-N-(2,3-dimethylcyclohexyl)acetamide
PubChem CID61374962
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-azido-N-(2,3-dimethylcyclohexyl)acetamide
SMILESCC1CCCC(NC(=O)CN=[N+]=[N-])C1C
InChIInChI=1S/C10H18N4O/c1-7-4-3-5-9(8(7)2)13-10(15)6-12-14-11/h7-9H,3-6H2,1-2H3,(H,13,15)
InChIKeySNIZQZUTYYPIOA-UHFFFAOYSA-N
XLogP2.24
TPSA77.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

N-(2,3-dimethylcyclohexyl)-2-(propan-2-ylamino)acetamide
CID 60648714
5-[[(1S,2S,3R)-2,3-dimethylcyclohexyl]amino]-5-oxopentanoic acid
CID 7317755
N-(2,3-dimethylcyclohexyl)tridecanamide
CID 57307251
N-cyclopropyl-2-[[2-[[(1R,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl]-methylamino]acetamide
CID 11934719
methyl N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]carbamate
CID 47303429
N-(2,3-dimethylcyclohexyl)decanamide;ethane
CID 143436811
2-bromo-N-(2-methylcyclopentyl)acetamide
CID 63681266
2-[(2,3-dimethylcyclohexyl)amino]-2-oxoacetic acid
CID 43445011
N-(2,3-dimethylcyclohexyl)-2-(prop-2-enylamino)acetamide
CID 78908844
tert-butyl 4-[(2,3-dimethylcyclohexyl)amino]-4-oxobutanoate
CID 106706973
N-(2,3-dimethylcyclohexyl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119676189
N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-4-(4-methylphenyl)-4-oxobutanamide
CID 51671096

Frequently Asked Questions

What is the IUPAC name of 2-azido-N-(2,3-dimethylcyclohexyl)acetamide?
The IUPAC name of 2-azido-N-(2,3-dimethylcyclohexyl)acetamide (CID 61374962) is 2-azido-N-(2,3-dimethylcyclohexyl)acetamide.
What is the SMILES notation for 2-azido-N-(2,3-dimethylcyclohexyl)acetamide?
The canonical SMILES for 2-azido-N-(2,3-dimethylcyclohexyl)acetamide is CC1CCCC(NC(=O)CN=[N+]=[N-])C1C.
What is the InChIKey of 2-azido-N-(2,3-dimethylcyclohexyl)acetamide?
The InChIKey is SNIZQZUTYYPIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-7-4-3-5-9(8(7)2)13-10(15)6-12-14-11/h7-9H,3-6H2,1-2H3,(H,13,15).
What are the key properties of 2-azido-N-(2,3-dimethylcyclohexyl)acetamide?
2-azido-N-(2,3-dimethylcyclohexyl)acetamide has a molecular weight of 210.28 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azido-N-(2,3-dimethylcyclohexyl)acetamide is sourced from PubChem (CID 61374962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).