1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide

C12H22N2O2 — CID 142602835

IUPAC1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide
SMILESNC(=O)C1(N2CCC(CO)CC2)CCCC1
InChIInChI=1S/C12H22N2O2/c13-11(16)12(5-1-2-6-12)14-7-3-10(9-15)4-8-14/h10,15H,1-9H2,(H2,13,16)
InChIKeyUSFNRCWCDZGMSK-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.49
Rot. Bonds3

About 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide

1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide (PubChem CID 142602835) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide
PubChem CID142602835
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide
SMILESNC(=O)C1(N2CCC(CO)CC2)CCCC1
InChIInChI=1S/C12H22N2O2/c13-11(16)12(5-1-2-6-12)14-7-3-10(9-15)4-8-14/h10,15H,1-9H2,(H2,13,16)
InChIKeyUSFNRCWCDZGMSK-UHFFFAOYSA-N
XLogP0.49
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide?
The IUPAC name of 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide (CID 142602835) is 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide is NC(=O)C1(N2CCC(CO)CC2)CCCC1.
What is the InChIKey of 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide?
The InChIKey is USFNRCWCDZGMSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c13-11(16)12(5-1-2-6-12)14-7-3-10(9-15)4-8-14/h10,15H,1-9H2,(H2,13,16).
What are the key properties of 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide?
1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(hydroxymethyl)piperidin-1-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 142602835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).