N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide

C13H24N2O — CID 112541972

IUPACN-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide
SMILESCCC1CC(NC(C)=O)CN(CC2CC2)C1
InChIInChI=1S/C13H24N2O/c1-3-11-6-13(14-10(2)16)9-15(7-11)8-12-4-5-12/h11-13H,3-9H2,1-2H3,(H,14,16)
InChIKeyHDFXPRVLIUIQRS-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.63
Rot. Bonds4

About N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide

N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide (PubChem CID 112541972) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide
PubChem CID112541972
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide
SMILESCCC1CC(NC(C)=O)CN(CC2CC2)C1
InChIInChI=1S/C13H24N2O/c1-3-11-6-13(14-10(2)16)9-15(7-11)8-12-4-5-12/h11-13H,3-9H2,1-2H3,(H,14,16)
InChIKeyHDFXPRVLIUIQRS-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]carbamate
CID 112544049
N-[1-(cyclopentylmethyl)-5-(2-hydroxyethyl)piperidin-3-yl]acetamide
CID 112542022
1-(cyclopropylmethyl)-5-ethyl-N-propylpiperidin-3-amine
CID 83991199
N-(1-acetyl-5-ethylpiperidin-3-yl)acetamide
CID 112541798
benzyl N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]carbamate
CID 112545085
methyl N-[1-(cyclopropylmethyl)-5-propylpiperidin-3-yl]carbamate
CID 112543409
methyl N-[1,5-bis(cyclopropylmethyl)piperidin-3-yl]carbamate
CID 112543412
1-(cyclopropylmethyl)-5-ethyl-N-(3-methylbutyl)piperidin-3-amine
CID 83995985
(3S,5S)-1-(cyclopropylmethyl)-5-ethylpiperidin-3-ol
CID 138739789
N-(1-butanoyl-5-ethylpiperidin-3-yl)acetamide
CID 112541827
N-(cyclobutylmethyl)-1-(cyclopentylmethyl)-5-ethylpiperidin-3-amine
CID 83997430
1-(cyclopentylmethyl)-5-ethyl-N-propylpiperidin-3-amine
CID 83991259

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide?
The IUPAC name of N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide (CID 112541972) is N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide.
What is the SMILES notation for N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide?
The canonical SMILES for N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide is CCC1CC(NC(C)=O)CN(CC2CC2)C1.
What is the InChIKey of N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide?
The InChIKey is HDFXPRVLIUIQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-11-6-13(14-10(2)16)9-15(7-11)8-12-4-5-12/h11-13H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide?
N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide has a molecular weight of 224.35 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide is sourced from PubChem (CID 112541972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).