2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide

C12H23NO2 — CID 103279737

IUPAC2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide
SMILESCCC(CC)C(=O)NCC1CCC(O)C1
InChIInChI=1S/C12H23NO2/c1-3-10(4-2)12(15)13-8-9-5-6-11(14)7-9/h9-11,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyTYRPFQLAJOPCQS-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.70
Rot. Bonds5

About 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide

2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide (PubChem CID 103279737) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide
PubChem CID103279737
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide
SMILESCCC(CC)C(=O)NCC1CCC(O)C1
InChIInChI=1S/C12H23NO2/c1-3-10(4-2)12(15)13-8-9-5-6-11(14)7-9/h9-11,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyTYRPFQLAJOPCQS-UHFFFAOYSA-N
XLogP1.70
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 ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[(3-hydroxycyclopentyl)methyl]hexanamide
CID 103279742
N-[(3-hydroxycyclopentyl)methyl]-2-sulfanylpropanamide
CID 106137756
2-amino-N-[(3-hydroxycyclopentyl)methyl]propanamide
CID 106134063
N-[(3-hydroxycyclopentyl)methyl]-2-methoxypropanamide
CID 103279856
2-amino-N-[(3-hydroxycyclopentyl)methyl]hexanamide
CID 106134012
N-[(4-hydroxycyclohexyl)methyl]-2-methylbutanamide
CID 106123043
2-amino-N-[(3-hydroxycyclohexyl)methyl]butanamide
CID 103950304
methyl N-[(3-hydroxycyclopentyl)methyl]carbamate
CID 103279767
1-[(3-hydroxycyclopentyl)methyl]-3-propylurea
CID 103207904
2-bromo-N-[(3-hydroxycyclopentyl)methyl]-2-methylpropanamide
CID 106127935
2-[acetyl(methyl)amino]-N-[(3-hydroxycyclopentyl)methyl]acetamide
CID 103280418
2-(carbamoylamino)-N-[(3-hydroxycyclopentyl)methyl]-3-methylbutanamide
CID 103282628

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide?
The IUPAC name of 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide (CID 103279737) is 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide?
The canonical SMILES for 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide is CCC(CC)C(=O)NCC1CCC(O)C1.
What is the InChIKey of 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide?
The InChIKey is TYRPFQLAJOPCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-10(4-2)12(15)13-8-9-5-6-11(14)7-9/h9-11,14H,3-8H2,1-2H3,(H,13,15).
What are the key properties of 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide?
2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide has a molecular weight of 213.32 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide is sourced from PubChem (CID 103279737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).