[2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone

C17H25N3O — CID 133398555

IUPAC[2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
SMILESCN(CCC1CC1)c1ncccc1C(=O)N1CCCCC1
InChIInChI=1S/C17H25N3O/c1-19(13-9-14-7-8-14)16-15(6-5-10-18-16)17(21)20-11-3-2-4-12-20/h5-6,10,14H,2-4,7-9,11-13H2,1H3
InChIKeyYXFOSFICKXZHBK-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.94
Rot. Bonds5

About [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone

[2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone (PubChem CID 133398555) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
PubChem CID133398555
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name[2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
SMILESCN(CCC1CC1)c1ncccc1C(=O)N1CCCCC1
InChIInChI=1S/C17H25N3O/c1-19(13-9-14-7-8-14)16-15(6-5-10-18-16)17(21)20-11-3-2-4-12-20/h5-6,10,14H,2-4,7-9,11-13H2,1H3
InChIKeyYXFOSFICKXZHBK-UHFFFAOYSA-N
XLogP2.94
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 131942429
[2-(dimethylamino)-3-pyridinyl]-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 110311478
2-[[3-(piperidine-1-carbonyl)-2-pyridinyl]-propylamino]acetic acid
CID 122051429
[2-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 134697352
(2-bromo-3-pyridinyl)-(4-propylazepan-1-yl)methanone
CID 103752661
[2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone
CID 3192324
[2-[cyclohexyl(methyl)amino]-3-pyridinyl]-[(3S)-3-hydroxy-3-(hydroxymethyl)piperidin-1-yl]methanone
CID 95716026
[2-(4-benzylpiperidin-1-yl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 1441062
N-cyclohexyl-N-methyl-2-[methyl(propyl)amino]pyridine-3-carboxamide
CID 141207977
tert-butyl 4-[2-(dimethylamino)pyridine-3-carbonyl]piperazine-1-carboxylate
CID 110312079
1-[4-(2-piperidin-1-ylpyridine-3-carbonyl)-1,4-diazepan-1-yl]ethanone
CID 56813825
(3-methylpiperidin-1-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 84576155

Frequently Asked Questions

What is the IUPAC name of [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
The IUPAC name of [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone (CID 133398555) is [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone.
What is the SMILES notation for [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
The canonical SMILES for [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone is CN(CCC1CC1)c1ncccc1C(=O)N1CCCCC1.
What is the InChIKey of [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
The InChIKey is YXFOSFICKXZHBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-19(13-9-14-7-8-14)16-15(6-5-10-18-16)17(21)20-11-3-2-4-12-20/h5-6,10,14H,2-4,7-9,11-13H2,1H3.
What are the key properties of [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
[2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone has a molecular weight of 287.41 g/mol, XLogP of 2.94, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-cyclopropylethyl(methyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 133398555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).