1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide

C14H27N3O2 — CID 54873960

IUPAC1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide
SMILESCN1CCC(N(CCO)C(=O)C2(N)CCCC2)CC1
InChIInChI=1S/C14H27N3O2/c1-16-8-4-12(5-9-16)17(10-11-18)13(19)14(15)6-2-3-7-14/h12,18H,2-11,15H2,1H3
InChIKeyZCNCRRKYORAWKY-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.17
Rot. Bonds4

About 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide

1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide (PubChem CID 54873960) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide
PubChem CID54873960
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide
SMILESCN1CCC(N(CCO)C(=O)C2(N)CCCC2)CC1
InChIInChI=1S/C14H27N3O2/c1-16-8-4-12(5-9-16)17(10-11-18)13(19)14(15)6-2-3-7-14/h12,18H,2-11,15H2,1H3
InChIKeyZCNCRRKYORAWKY-UHFFFAOYSA-N
XLogP0.17
TPSA69.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide (CID 54873960) is 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide is CN1CCC(N(CCO)C(=O)C2(N)CCCC2)CC1.
What is the InChIKey of 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
The InChIKey is ZCNCRRKYORAWKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-16-8-4-12(5-9-16)17(10-11-18)13(19)14(15)6-2-3-7-14/h12,18H,2-11,15H2,1H3.
What are the key properties of 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 54873960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).