2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide

C14H29N3O — CID 60820308

IUPAC2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide
SMILESCNC1CCN(C(C)C(=O)NCCC(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-11(2)5-8-16-14(18)12(3)17-9-6-13(15-4)7-10-17/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyNANQAMUUCBKUDD-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.22
Rot. Bonds6

About 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide

2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide (PubChem CID 60820308) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide.

Molecular Properties

Compound Name2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide
PubChem CID60820308
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide
SMILESCNC1CCN(C(C)C(=O)NCCC(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-11(2)5-8-16-14(18)12(3)17-9-6-13(15-4)7-10-17/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyNANQAMUUCBKUDD-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 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 ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(methylamino)piperidin-1-yl]-N-(2-methylpropyl)propanamide
CID 60820142
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-(3-methylbutyl)propanamide
CID 78963745
N-cyclopropyl-2-[4-(methylamino)piperidin-1-yl]propanamide
CID 60820306
2-[3-(1-aminoethyl)piperidin-1-yl]-N-(3-methylbutyl)propanamide
CID 55258927
2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide
CID 63761130
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 60820303
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride
CID 119923499
methyl 1-[1-(3-methylbutylamino)-1-oxopropan-2-yl]piperidine-3-carboxylate
CID 78920649
N-(3-methylbutyl)-2-[(1-methylpiperidin-4-yl)amino]propanamide
CID 43373502
2-[3-methyl-4-(methylamino)piperidin-1-yl]-N-(2-methylpropyl)propanamide
CID 114499044
2-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-N-(3-methylbutyl)propanamide
CID 63310111
N-butyl-2-[3-(methylamino)piperidin-1-yl]propanamide
CID 55086301

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide?
The IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide (CID 60820308) is 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide.
What is the SMILES notation for 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide?
The canonical SMILES for 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide is CNC1CCN(C(C)C(=O)NCCC(C)C)CC1.
What is the InChIKey of 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide?
The InChIKey is NANQAMUUCBKUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)5-8-16-14(18)12(3)17-9-6-13(15-4)7-10-17/h11-13,15H,5-10H2,1-4H3,(H,16,18).
What are the key properties of 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide?
2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide has a molecular weight of 255.41 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide is sourced from PubChem (CID 60820308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).