2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide

C16H30N2O2 — CID 65122600

IUPAC2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide
SMILESNC1(CC(=O)NCC2(O)CCCCCC2)CCCCC1
InChIInChI=1S/C16H30N2O2/c17-15(8-4-3-5-9-15)12-14(19)18-13-16(20)10-6-1-2-7-11-16/h20H,1-13,17H2,(H,18,19)
InChIKeyOPHKOZBWJQVFAT-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.24
Rot. Bonds4

About 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide

2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide (PubChem CID 65122600) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide
PubChem CID65122600
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide
SMILESNC1(CC(=O)NCC2(O)CCCCCC2)CCCCC1
InChIInChI=1S/C16H30N2O2/c17-15(8-4-3-5-9-15)12-14(19)18-13-16(20)10-6-1-2-7-11-16/h20H,1-13,17H2,(H,18,19)
InChIKeyOPHKOZBWJQVFAT-UHFFFAOYSA-N
XLogP2.24
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclobutyl)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide
CID 81130546
N-[(1-hydroxycyclobutyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111539371
2-(1-aminocyclohexyl)-N-(2-amino-2-oxoethyl)acetamide
CID 64684917
2-amino-N-[(1-hydroxycycloheptyl)methyl]acetamide
CID 65122282
2-[1-(aminomethyl)cyclobutyl]-N-[(1-hydroxycycloheptyl)methyl]acetamide
CID 81169440
1-[2-[(1-hydroxycyclopentyl)methylamino]-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 65108325
2-[1-[2-[(1-hydroxycyclopentyl)methylamino]-2-oxoethyl]cyclohexyl]acetic acid
CID 65108169
2-hydroxy-N-[(1-hydroxycyclopentyl)methyl]acetamide
CID 130634547
3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide
CID 111331912
2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide
CID 113450228
2-(1-aminocyclopentyl)-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 64686159
2-(1-aminocyclopentyl)-N-(cyclopropylmethyl)acetamide
CID 64685708

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide (CID 65122600) is 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide is NC1(CC(=O)NCC2(O)CCCCCC2)CCCCC1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide?
The InChIKey is OPHKOZBWJQVFAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c17-15(8-4-3-5-9-15)12-14(19)18-13-16(20)10-6-1-2-7-11-16/h20H,1-13,17H2,(H,18,19).
What are the key properties of 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide?
2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide has a molecular weight of 282.43 g/mol, XLogP of 2.24, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-[(1-hydroxycycloheptyl)methyl]acetamide is sourced from PubChem (CID 65122600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).