2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide

C15H30N4O — CID 80553139

IUPAC2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)C(C)N1CCC(N2CCC(N)CC2)C1
InChIInChI=1S/C15H30N4O/c1-3-7-17-15(20)12(2)19-10-6-14(11-19)18-8-4-13(16)5-9-18/h12-14H,3-11,16H2,1-2H3,(H,17,20)
InChIKeyLSZGEYLDKZGMQR-UHFFFAOYSA-N
MW282.43 g/mol
LogP0.40
Rot. Bonds5

About 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide

2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide (PubChem CID 80553139) has the molecular formula C15H30N4O and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide.

Molecular Properties

Compound Name2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide
PubChem CID80553139
Molecular FormulaC15H30N4O
Molecular Weight282.43 g/mol
Exact Mass282.24
IUPAC Name2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)C(C)N1CCC(N2CCC(N)CC2)C1
InChIInChI=1S/C15H30N4O/c1-3-7-17-15(20)12(2)19-10-6-14(11-19)18-8-4-13(16)5-9-18/h12-14H,3-11,16H2,1-2H3,(H,17,20)
InChIKeyLSZGEYLDKZGMQR-UHFFFAOYSA-N
XLogP0.40
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-butylpropanamide
CID 80553344
2-(3-aminopyrrolidin-1-yl)-N-butylpropanamide
CID 62068647
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-propylpropanamide
CID 112630167
2-[3-(2-aminoethyl)pyrrolidin-1-yl]-N-propylpropanamide
CID 114802599
1-(1-heptan-4-ylpyrrolidin-3-yl)piperidin-4-amine
CID 80552662
methyl 3-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]butanoate
CID 80552988
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 115302045
2-[1-[1-oxo-1-(propylamino)propan-2-yl]piperidin-4-yl]acetic acid
CID 79609150
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-propylpropanamide;hydrochloride
CID 119928199
2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]-N-propylpropanamide
CID 63847727
2-(3-aminoazetidin-1-yl)-N-butylpropanamide
CID 63760897
2-[3-(ethylaminomethyl)piperidin-1-yl]-N-propylpropanamide
CID 63849842

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide?
The IUPAC name of 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide (CID 80553139) is 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide.
What is the SMILES notation for 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide?
The canonical SMILES for 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide is CCCNC(=O)C(C)N1CCC(N2CCC(N)CC2)C1.
What is the InChIKey of 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide?
The InChIKey is LSZGEYLDKZGMQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O/c1-3-7-17-15(20)12(2)19-10-6-14(11-19)18-8-4-13(16)5-9-18/h12-14H,3-11,16H2,1-2H3,(H,17,20).
What are the key properties of 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide?
2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide has a molecular weight of 282.43 g/mol, XLogP of 0.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-propylpropanamide is sourced from PubChem (CID 80553139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).