2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide

C16H30N4O — CID 63909753

IUPAC2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide
SMILESNC(=O)C(N)(CN1CCC(N2CCCCC2)CC1)C1CC1
InChIInChI=1S/C16H30N4O/c17-15(21)16(18,13-4-5-13)12-19-10-6-14(7-11-19)20-8-2-1-3-9-20/h13-14H,1-12,18H2,(H2,17,21)
InChIKeyPMPLWEJTOXVUFO-UHFFFAOYSA-N
MW294.44 g/mol
LogP0.53
Rot. Bonds5

About 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide

2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide (PubChem CID 63909753) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide
PubChem CID63909753
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide
SMILESNC(=O)C(N)(CN1CCC(N2CCCCC2)CC1)C1CC1
InChIInChI=1S/C16H30N4O/c17-15(21)16(18,13-4-5-13)12-19-10-6-14(7-11-19)20-8-2-1-3-9-20/h13-14H,1-12,18H2,(H2,17,21)
InChIKeyPMPLWEJTOXVUFO-UHFFFAOYSA-N
XLogP0.53
TPSA75.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-(8-azaspiro[4.5]decan-8-yl)-2-cyclopropylpropanamide
CID 63926414
methyl 2-amino-2-cyclopropyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanoate
CID 63925815
2-cyclopropyl-2-(methylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propanamide
CID 63926418
methyl 2-amino-3-(azepan-1-yl)-2-cyclopropylpropanoate
CID 63907282
ethyl 2-amino-3-(azepan-1-yl)-2-cyclopropylpropanoate
CID 63907466
2-amino-2-cyclopropyl-3-(3-phenylpyrrolidin-1-yl)propanamide
CID 63926602
[1,4'-Bipiperidine]-1'-aceticacid,potassiumsalt(1:1)
CID 70199542
3-(3-piperidin-1-ylpyrrolidin-1-yl)propanamide
CID 63171229
2-amino-2-cyclopropyl-3-(1-oxo-1,4-thiazinan-4-yl)propanoic acid
CID 63909774
1-(4-pyrrolidin-1-ylpiperidin-1-yl)propan-2-one
CID 58870209
2-methyl-4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
CID 64679336
2-amino-2-methyl-1-(4-piperidin-1-ylpiperidin-1-yl)propan-1-one
CID 61264661

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide (CID 63909753) is 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide is NC(=O)C(N)(CN1CCC(N2CCCCC2)CC1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide?
The InChIKey is PMPLWEJTOXVUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c17-15(21)16(18,13-4-5-13)12-19-10-6-14(7-11-19)20-8-2-1-3-9-20/h13-14H,1-12,18H2,(H2,17,21).
What are the key properties of 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide?
2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide has a molecular weight of 294.44 g/mol, XLogP of 0.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide is sourced from PubChem (CID 63909753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).