2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide

C19H32N4O — CID 142327146

IUPAC2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide
SMILESCC(C)C(N)C(=O)NC1(Cc2ccccn2)CCN(C(C)C)CC1
InChIInChI=1S/C19H32N4O/c1-14(2)17(20)18(24)22-19(13-16-7-5-6-10-21-16)8-11-23(12-9-19)15(3)4/h5-7,10,14-15,17H,8-9,11-13,20H2,1-4H3,(H,22,24)
InChIKeyNULPUDLSQQJYGJ-UHFFFAOYSA-N
MW332.49 g/mol
LogP1.97
Rot. Bonds6

About 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide

2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide (PubChem CID 142327146) has the molecular formula C19H32N4O and a molecular weight of 332.49 g/mol. Its IUPAC name is 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide.

Molecular Properties

Compound Name2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide
PubChem CID142327146
Molecular FormulaC19H32N4O
Molecular Weight332.49 g/mol
Exact Mass332.26
IUPAC Name2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide
SMILESCC(C)C(N)C(=O)NC1(Cc2ccccn2)CCN(C(C)C)CC1
InChIInChI=1S/C19H32N4O/c1-14(2)17(20)18(24)22-19(13-16-7-5-6-10-21-16)8-11-23(12-9-19)15(3)4/h5-7,10,14-15,17H,8-9,11-13,20H2,1-4H3,(H,22,24)
InChIKeyNULPUDLSQQJYGJ-UHFFFAOYSA-N
XLogP1.97
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[1-(1-methylsulfanylethyl)-4-(pyridin-2-ylmethyl)piperidin-4-yl]propanamide
CID 134505885
1-(4-methyl-1-propan-2-ylpiperidin-4-yl)-2-pyridin-2-ylethanone
CID 159270457
(2R)-2-amino-N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-4-(pyridin-2-ylmethyl)piperidin-4-yl]-3-methylbutanamide
CID 134434853
2-amino-3-methyl-N-(2-pyridin-2-ylethyl)butanamide
CID 24698631
N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide
CID 134505417
4-propan-2-yl-N-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 113103329
N-[1-[(methyldisulfanyl)methyl]-4-(pyridin-2-ylmethyl)piperidin-4-yl]-2-morpholin-4-ylacetamide
CID 155455782
N-[6-oxo-1-propan-2-yl-3-(pyridin-2-ylmethyl)piperidin-3-yl]butanamide
CID 74221816
2-methoxy-N-[6-oxo-1-propan-2-yl-3-(pyridin-2-ylmethyl)piperidin-3-yl]acetamide
CID 74221911
9H-fluoren-9-ylmethyl N-[(2R)-1-oxo-1-[[4-(pyridin-2-ylmethyl)piperidin-4-yl]amino]propan-2-yl]carbamate
CID 134434896
4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide
CID 134515265
N-[6-oxo-1-propan-2-yl-3-(pyridin-2-ylmethyl)piperidin-3-yl]morpholine-4-carboxamide
CID 74221907

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide?
The IUPAC name of 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide (CID 142327146) is 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide.
What is the SMILES notation for 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide?
The canonical SMILES for 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide is CC(C)C(N)C(=O)NC1(Cc2ccccn2)CCN(C(C)C)CC1.
What is the InChIKey of 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide?
The InChIKey is NULPUDLSQQJYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N4O/c1-14(2)17(20)18(24)22-19(13-16-7-5-6-10-21-16)8-11-23(12-9-19)15(3)4/h5-7,10,14-15,17H,8-9,11-13,20H2,1-4H3,(H,22,24).
What are the key properties of 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide?
2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide has a molecular weight of 332.49 g/mol, XLogP of 1.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide is sourced from PubChem (CID 142327146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).