N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide

C15H29N3O2 — CID 60947774

IUPACN-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide
SMILESCC(C)CC(N)C(=O)N1CCC(NC(=O)C(C)C)CC1
InChIInChI=1S/C15H29N3O2/c1-10(2)9-13(16)15(20)18-7-5-12(6-8-18)17-14(19)11(3)4/h10-13H,5-9,16H2,1-4H3,(H,17,19)
InChIKeyWDOSCGMZGDPIBE-UHFFFAOYSA-N
MW283.42 g/mol
LogP1.12
Rot. Bonds5

About N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide

N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide (PubChem CID 60947774) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide
PubChem CID60947774
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC NameN-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide
SMILESCC(C)CC(N)C(=O)N1CCC(NC(=O)C(C)C)CC1
InChIInChI=1S/C15H29N3O2/c1-10(2)9-13(16)15(20)18-7-5-12(6-8-18)17-14(19)11(3)4/h10-13H,5-9,16H2,1-4H3,(H,17,19)
InChIKeyWDOSCGMZGDPIBE-UHFFFAOYSA-N
XLogP1.12
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[(2S)-2-amino-4-methylpentanoyl]piperidin-4-yl]-2-methylpropanamide
CID 61164143
N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]propanamide
CID 54872159
N-[1-(2-amino-3-methoxypropanoyl)piperidin-4-yl]-2-methylpropanamide
CID 81083203
N-[1-[(2S)-2-amino-4-methylpentanoyl]pyrrolidin-3-yl]acetamide
CID 113402254
2-amino-1-(4-hydroxypiperidin-1-yl)-4-methylpentan-1-one;hydrochloride
CID 47003200
2-amino-N-[1-(2-methylpropanoyl)piperidin-4-yl]butanamide
CID 43711887
1-[1-[(2S)-2-amino-4-methylpentanoyl]piperidin-4-yl]-3-(4-fluorophenyl)urea
CID 119734475
N-[1-[(2S)-2-amino-4-methylpentanoyl]piperidin-4-yl]-2-methylbenzamide;hydrochloride
CID 119721491
2-amino-4-methyl-1-pyrrolidin-1-ylpentan-1-one
CID 20500850
(2S)-2-amino-1-[4-(ethylaminomethyl)piperidin-1-yl]-4-methylpentan-1-one
CID 122080878
(2R)-2-amino-4-methyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)pentan-1-one
CID 93469877
2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide
CID 43711760

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide?
The IUPAC name of N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide (CID 60947774) is N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide.
What is the SMILES notation for N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide?
The canonical SMILES for N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide is CC(C)CC(N)C(=O)N1CCC(NC(=O)C(C)C)CC1.
What is the InChIKey of N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide?
The InChIKey is WDOSCGMZGDPIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-10(2)9-13(16)15(20)18-7-5-12(6-8-18)17-14(19)11(3)4/h10-13H,5-9,16H2,1-4H3,(H,17,19).
What are the key properties of N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide?
N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide has a molecular weight of 283.42 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide is sourced from PubChem (CID 60947774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).