2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide

C15H30N4O — CID 63054591

IUPAC2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide
SMILESCNC(CCN1CCC(N2CCCCC2)CC1)C(N)=O
InChIInChI=1S/C15H30N4O/c1-17-14(15(16)20)7-12-18-10-5-13(6-11-18)19-8-3-2-4-9-19/h13-14,17H,2-12H2,1H3,(H2,16,20)
InChIKeyGNAZTIRHMOKQJA-UHFFFAOYSA-N
MW282.43 g/mol
LogP0.40
Rot. Bonds6

About 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide

2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide (PubChem CID 63054591) has the molecular formula C15H30N4O and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide.

Molecular Properties

Compound Name2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide
PubChem CID63054591
Molecular FormulaC15H30N4O
Molecular Weight282.43 g/mol
Exact Mass282.24
IUPAC Name2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide
SMILESCNC(CCN1CCC(N2CCCCC2)CC1)C(N)=O
InChIInChI=1S/C15H30N4O/c1-17-14(15(16)20)7-12-18-10-5-13(6-11-18)19-8-3-2-4-9-19/h13-14,17H,2-12H2,1H3,(H2,16,20)
InChIKeyGNAZTIRHMOKQJA-UHFFFAOYSA-N
XLogP0.40
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
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-(methylamino)-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanamide
CID 55159335
4-[4-(dimethylamino)piperidin-1-yl]-2-(methylamino)butanamide
CID 63028069
2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butan-1-ol
CID 64826674
4-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-(methylamino)butanamide
CID 115561507
4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
CID 61215952
3-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-2-(methylamino)propanamide
CID 63151183
2-(cyclopropylamino)-4-(4-cyclopropylpiperazin-1-yl)butanamide
CID 55144900
2-methyl-4-piperidin-1-ylbutanamide
CID 23061678
4-(4-methylpiperidin-1-yl)-2-(propan-2-ylamino)butanamide
CID 63028170
4-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64826874
2,2-dimethyl-4-(4-piperidin-1-ylpiperidin-1-yl)butanoic acid
CID 65248275
4-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)butanenitrile
CID 63027929

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide?
The IUPAC name of 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide (CID 63054591) is 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide.
What is the SMILES notation for 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide?
The canonical SMILES for 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide is CNC(CCN1CCC(N2CCCCC2)CC1)C(N)=O.
What is the InChIKey of 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide?
The InChIKey is GNAZTIRHMOKQJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O/c1-17-14(15(16)20)7-12-18-10-5-13(6-11-18)19-8-3-2-4-9-19/h13-14,17H,2-12H2,1H3,(H2,16,20).
What are the key properties of 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide?
2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide has a molecular weight of 282.43 g/mol, XLogP of 0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide is sourced from PubChem (CID 63054591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).