2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide

C19H27NO3 — CID 75387676

IUPAC2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide
SMILESO=C(CC1(O)CCCCC1)NCC1(C(O)c2ccccc2)CC1
InChIInChI=1S/C19H27NO3/c21-16(13-19(23)9-5-2-6-10-19)20-14-18(11-12-18)17(22)15-7-3-1-4-8-15/h1,3-4,7-8,17,22-23H,2,5-6,9-14H2,(H,20,21)
InChIKeyXRTPWZOUFLNBPY-UHFFFAOYSA-N
MW317.43 g/mol
LogP2.70
Rot. Bonds6

About 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide

2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide (PubChem CID 75387676) has the molecular formula C19H27NO3 and a molecular weight of 317.43 g/mol. Its IUPAC name is 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide
PubChem CID75387676
Molecular FormulaC19H27NO3
Molecular Weight317.43 g/mol
Exact Mass317.20
IUPAC Name2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide
SMILESO=C(CC1(O)CCCCC1)NCC1(C(O)c2ccccc2)CC1
InChIInChI=1S/C19H27NO3/c21-16(13-19(23)9-5-2-6-10-19)20-14-18(11-12-18)17(22)15-7-3-1-4-8-15/h1,3-4,7-8,17,22-23H,2,5-6,9-14H2,(H,20,21)
InChIKeyXRTPWZOUFLNBPY-UHFFFAOYSA-N
XLogP2.70
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzhydryl-2-(1-hydroxycyclopentyl)acetamide
CID 111430201
N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]-2-morpholin-4-ylacetamide
CID 110011720
(2R)-2-amino-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]propanamide
CID 120873430
2-(1-hydroxycyclopentyl)-N-[(4-phenyloxan-4-yl)methyl]acetamide
CID 111430576
N-[(1-hydroxycyclobutyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111539371
N-[(1-hydroxycyclopentyl)methyl]-3-phenylbutanamide
CID 110626464
(2S)-N-[[1-[(R)-hydroxy(phenyl)methyl]cyclopropyl]methyl]-2,4-dimethylpent-4-enamide
CID 99784868
2-[[2-(1-hydroxycyclopentyl)acetyl]amino]-2-phenylacetamide
CID 111430361
N-[cyclobutyl(phenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111538084
1-[(1-hydroxycyclohexyl)methyl]-3-(1-phenylethyl)urea
CID 110936427
2-chloro-N-[(1-hydroxycyclopentyl)methyl]-2-phenylacetamide
CID 65105279
phenyl 2-(1-hydroxycyclohexyl)acetate
CID 57448980

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide?
The IUPAC name of 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide (CID 75387676) is 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide.
What is the SMILES notation for 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide?
The canonical SMILES for 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide is O=C(CC1(O)CCCCC1)NCC1(C(O)c2ccccc2)CC1.
What is the InChIKey of 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide?
The InChIKey is XRTPWZOUFLNBPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO3/c21-16(13-19(23)9-5-2-6-10-19)20-14-18(11-12-18)17(22)15-7-3-1-4-8-15/h1,3-4,7-8,17,22-23H,2,5-6,9-14H2,(H,20,21).
What are the key properties of 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide?
2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide has a molecular weight of 317.43 g/mol, XLogP of 2.70, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclohexyl)-N-[[1-[hydroxy(phenyl)methyl]cyclopropyl]methyl]acetamide is sourced from PubChem (CID 75387676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).