N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide

C12H23NO2 — CID 114875416

IUPACN-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide
SMILESCCC(C)CC(=O)NCC1(O)CCCC1
InChIInChI=1S/C12H23NO2/c1-3-10(2)8-11(14)13-9-12(15)6-4-5-7-12/h10,15H,3-9H2,1-2H3,(H,13,14)
InChIKeyBAIJVFZQUNRTMP-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.84
Rot. Bonds5

About N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide

N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide (PubChem CID 114875416) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide
PubChem CID114875416
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide
SMILESCCC(C)CC(=O)NCC1(O)CCCC1
InChIInChI=1S/C12H23NO2/c1-3-10(2)8-11(14)13-9-12(15)6-4-5-7-12/h10,15H,3-9H2,1-2H3,(H,13,14)
InChIKeyBAIJVFZQUNRTMP-UHFFFAOYSA-N
XLogP1.84
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(bromomethyl)cyclopentyl]methyl]-3-methylpentanamide
CID 114877037
1-[(3-methylpentanoylamino)methyl]cyclopentane-1-carboxylic acid
CID 114873836
3-ethyl-N-[(1-hydroxycyclobutyl)methyl]-4-methylpentanamide
CID 111539695
2-hydroxy-N-[(1-hydroxycyclopentyl)methyl]acetamide
CID 130634547
N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 58767519
N-[(1-hydroxycyclopentyl)methyl]-3-phenylbutanamide
CID 110626464
2-chloro-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 65105224
1-[(2-methylbutylamino)methyl]cyclohexan-1-ol
CID 62692015
N-[(1-hydroxycyclopentyl)methyl]-2-(propylamino)acetamide
CID 65106366
N-[(1-hydroxycyclohexyl)methyl]-4-methoxypentanamide
CID 113375216
2-amino-N-[(1-hydroxycycloheptyl)methyl]acetamide
CID 65122282
N-[(1-hydroxycyclobutyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111539371

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide (CID 114875416) is N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide is CCC(C)CC(=O)NCC1(O)CCCC1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide?
The InChIKey is BAIJVFZQUNRTMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-10(2)8-11(14)13-9-12(15)6-4-5-7-12/h10,15H,3-9H2,1-2H3,(H,13,14).
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide?
N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide has a molecular weight of 213.32 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide is sourced from PubChem (CID 114875416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).