3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide

C13H24N4O — CID 80553937

IUPAC3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide
SMILESNC1CCN(C2CCN(C(=O)NC3CC3)C2)CC1
InChIInChI=1S/C13H24N4O/c14-10-3-6-16(7-4-10)12-5-8-17(9-12)13(18)15-11-1-2-11/h10-12H,1-9,14H2,(H,15,18)
InChIKeyWKXHBWWJSVUMPM-UHFFFAOYSA-N
MW252.36 g/mol
LogP0.36
Rot. Bonds2

About 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide

3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide (PubChem CID 80553937) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide
PubChem CID80553937
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide
SMILESNC1CCN(C2CCN(C(=O)NC3CC3)C2)CC1
InChIInChI=1S/C13H24N4O/c14-10-3-6-16(7-4-10)12-5-8-17(9-12)13(18)15-11-1-2-11/h10-12H,1-9,14H2,(H,15,18)
InChIKeyWKXHBWWJSVUMPM-UHFFFAOYSA-N
XLogP0.36
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-aminopiperidin-1-yl)-N-tert-butylpyrrolidine-1-carboxamide
CID 80553798
(3R)-3-amino-N-cyclopentylpyrrolidine-1-carboxamide
CID 115301653
3-(2,5-dihydropyrrol-1-yl)-N-(4-hydroxycyclohexyl)pyrrolidine-1-carboxamide
CID 111470896
1-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]propan-1-one
CID 80553918
[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-cyclobutylmethanone
CID 80553884
[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-(azepan-1-yl)methanone
CID 80552459
N-cyclohexyl-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine-2-carboxamide
CID 49289387
(3R)-N-(1-methylsulfonylpiperidin-4-yl)-3-pyrrolidin-1-ylpyrrolidine-1-carboxamide
CID 95168195
N-(4-aminocyclohexyl)azepane-1-carboxamide
CID 79152451
1-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-2-cyclobutylethanone
CID 103165068
[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 80553795
N-cyclopropyl-3-hydroxypyrrolidine-1-carboxamide
CID 62916085

Frequently Asked Questions

What is the IUPAC name of 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide?
The IUPAC name of 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide (CID 80553937) is 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide.
What is the SMILES notation for 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide?
The canonical SMILES for 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide is NC1CCN(C2CCN(C(=O)NC3CC3)C2)CC1.
What is the InChIKey of 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide?
The InChIKey is WKXHBWWJSVUMPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c14-10-3-6-16(7-4-10)12-5-8-17(9-12)13(18)15-11-1-2-11/h10-12H,1-9,14H2,(H,15,18).
What are the key properties of 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide?
3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-aminopiperidin-1-yl)-N-cyclopropylpyrrolidine-1-carboxamide is sourced from PubChem (CID 80553937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).