2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide

C14H29N3O — CID 65224886

IUPAC2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide
SMILESCCCC(CN)C(=O)NC1CCN(C(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-4-5-12(10-15)14(18)16-13-6-8-17(9-7-13)11(2)3/h11-13H,4-10,15H2,1-3H3,(H,16,18)
InChIKeySAUOZBQDRBOYTK-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds6

About 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide

2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide (PubChem CID 65224886) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide
PubChem CID65224886
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide
SMILESCCCC(CN)C(=O)NC1CCN(C(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-4-5-12(10-15)14(18)16-13-6-8-17(9-7-13)11(2)3/h11-13H,4-10,15H2,1-3H3,(H,16,18)
InChIKeySAUOZBQDRBOYTK-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide
CID 65225141
(2S)-2-amino-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 79024824
2-(aminomethyl)-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
CID 65225132
2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide;molecular hydrogen
CID 176982787
N-[(3R)-1-methylpyrrolidin-3-yl]-2-propylpentanamide
CID 167206837
2-(aminomethyl)-N-(2-methylcyclopropyl)pentanamide
CID 62397144
2-(aminomethyl)-N-(4-phenylcyclohexyl)pentanamide
CID 65225560
4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)pentanamide
CID 79200680
2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 76887361
3-amino-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 60842653
2-(aminomethyl)-N-[(1R)-1-cycloheptylethyl]pentanamide
CID 81393086
2-bromo-3-methyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 43700528

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide?
The IUPAC name of 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide (CID 65224886) is 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide?
The canonical SMILES for 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide is CCCC(CN)C(=O)NC1CCN(C(C)C)CC1.
What is the InChIKey of 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide?
The InChIKey is SAUOZBQDRBOYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-4-5-12(10-15)14(18)16-13-6-8-17(9-7-13)11(2)3/h11-13H,4-10,15H2,1-3H3,(H,16,18).
What are the key properties of 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide?
2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(1-propan-2-ylpiperidin-4-yl)pentanamide is sourced from PubChem (CID 65224886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).