N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide

C14H18ClNO2 — CID 111430252

IUPACN-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide
SMILESO=C(CC1(O)CCCC1)NCc1cccc(Cl)c1
InChIInChI=1S/C14H18ClNO2/c15-12-5-3-4-11(8-12)10-16-13(17)9-14(18)6-1-2-7-14/h3-5,8,18H,1-2,6-7,9-10H2,(H,16,17)
InChIKeyDPBBUQWJAYDFKK-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.65
Rot. Bonds4

About N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide

N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide (PubChem CID 111430252) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide
PubChem CID111430252
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC NameN-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide
SMILESO=C(CC1(O)CCCC1)NCc1cccc(Cl)c1
InChIInChI=1S/C14H18ClNO2/c15-12-5-3-4-11(8-12)10-16-13(17)9-14(18)6-1-2-7-14/h3-5,8,18H,1-2,6-7,9-10H2,(H,16,17)
InChIKeyDPBBUQWJAYDFKK-UHFFFAOYSA-N
XLogP2.65
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-aminocyclopentyl)-N-[(3-chlorophenyl)methyl]acetamide
CID 64684380
2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide
CID 111430199
N-[(3-cyanophenyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111520470
N-[[3-[[ethyl(methyl)amino]methyl]phenyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430735
2-(1-adamantyl)-N-[(3-chlorophenyl)methyl]acetamide
CID 2741139
N-[(3-chlorophenyl)methyl]propanamide
CID 17071125
2-(1-hydroxycyclopentyl)-N-(naphthalen-1-ylmethyl)acetamide
CID 111536548
1-[(3-chlorophenyl)methyl]cyclopentan-1-ol
CID 60798466
N-[(3-chlorophenyl)methyl]-1-cyanocyclohexane-1-carboxamide
CID 55071184
1-[(3-chlorophenyl)methyl]cycloheptan-1-ol
CID 60797404
3-bromo-N-[(3-chlorophenyl)methyl]propanamide
CID 82109966
4-chloro-N-[(3-chlorophenyl)methyl]butanamide
CID 17071148

Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide?
The IUPAC name of N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide (CID 111430252) is N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide is O=C(CC1(O)CCCC1)NCc1cccc(Cl)c1.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide?
The InChIKey is DPBBUQWJAYDFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c15-12-5-3-4-11(8-12)10-16-13(17)9-14(18)6-1-2-7-14/h3-5,8,18H,1-2,6-7,9-10H2,(H,16,17).
What are the key properties of N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide?
N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide has a molecular weight of 267.76 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide is sourced from PubChem (CID 111430252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).