2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide

C14H27N3O — CID 43711760

IUPAC2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide
SMILESCC(C)CC(N)C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C14H27N3O/c1-10(2)9-13(15)14(18)16-11-5-7-17(8-6-11)12-3-4-12/h10-13H,3-9,15H2,1-2H3,(H,16,18)
InChIKeyIAXCJRXRMKLQKV-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.10
Rot. Bonds5

About 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide

2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide (PubChem CID 43711760) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide
PubChem CID43711760
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide
SMILESCC(C)CC(N)C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C14H27N3O/c1-10(2)9-13(15)14(18)16-11-5-7-17(8-6-11)12-3-4-12/h10-13H,3-9,15H2,1-2H3,(H,16,18)
InChIKeyIAXCJRXRMKLQKV-UHFFFAOYSA-N
XLogP1.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-4-methyl-N-(1-methylsulfonylpiperidin-4-yl)pentanamide
CID 56865366
2-amino-4-methyl-N-(oxan-4-yl)pentanamide
CID 43610149
(2R)-2-amino-N-(1-cyclopentylpiperidin-4-yl)propanamide
CID 119846668
(2R)-2-amino-4-methyl-N-(1-oxothian-4-yl)pentanamide
CID 104904016
(2S)-2-amino-4-methyl-N-(1-oxothian-4-yl)pentanamide
CID 104864648
N-[1-[(2S)-2-amino-4-methylpentanoyl]piperidin-4-yl]-2-methylpropanamide
CID 61164143
N-[1-(2-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide
CID 60947774
(2R)-2-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide
CID 78984552
ethyl N-(1-cyclopropylpiperidin-4-yl)carbamate
CID 60709264
(2S)-2-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-4-methylpentanamide
CID 79401066
cis-(1R,3S)-3-[[(2R)-2-amino-4-methylpentanoyl]amino]cyclopentane-1-carboxylic acid
CID 114173473
(2R)-2-amino-4-methyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)pentan-1-one
CID 93469877

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide?
The IUPAC name of 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide (CID 43711760) is 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide.
What is the SMILES notation for 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide?
The canonical SMILES for 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide is CC(C)CC(N)C(=O)NC1CCN(C2CC2)CC1.
What is the InChIKey of 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide?
The InChIKey is IAXCJRXRMKLQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-10(2)9-13(15)14(18)16-11-5-7-17(8-6-11)12-3-4-12/h10-13H,3-9,15H2,1-2H3,(H,16,18).
What are the key properties of 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide?
2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide has a molecular weight of 253.39 g/mol, XLogP of 1.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-cyclopropylpiperidin-4-yl)-4-methylpentanamide is sourced from PubChem (CID 43711760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).