[4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone

C18H21N3O — CID 119561943

IUPAC[4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone
SMILESCNC1CCN(C(=O)c2cncc(-c3ccccc3)c2)CC1
InChIInChI=1S/C18H21N3O/c1-19-17-7-9-21(10-8-17)18(22)16-11-15(12-20-13-16)14-5-3-2-4-6-14/h2-6,11-13,17,19H,7-10H2,1H3
InChIKeyTZWMQWUDFPCXPO-UHFFFAOYSA-N
MW295.39 g/mol
LogP2.57
Rot. Bonds3

About [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone

[4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone (PubChem CID 119561943) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name[4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone
PubChem CID119561943
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name[4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone
SMILESCNC1CCN(C(=O)c2cncc(-c3ccccc3)c2)CC1
InChIInChI=1S/C18H21N3O/c1-19-17-7-9-21(10-8-17)18(22)16-11-15(12-20-13-16)14-5-3-2-4-6-14/h2-6,11-13,17,19H,7-10H2,1H3
InChIKeyTZWMQWUDFPCXPO-UHFFFAOYSA-N
XLogP2.57
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone 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

[4-(methylamino)piperidin-1-yl]-(4-phenylphenyl)methanone;hydrochloride
CID 119563632
(4-amino-3,3-dimethylpiperidin-1-yl)-(5-phenyl-3-pyridinyl)methanone
CID 120818980
N,N-dimethyl-4-(5-phenylpyridine-3-carbonyl)piperazine-1-carboxamide
CID 71920561
ethane;[4-(methylamino)piperidin-1-yl]-phenylmethanone
CID 145194562
(4-methylpiperidin-1-yl)-[5-(4-phenoxyphenyl)-3-pyridinyl]methanone
CID 46032979
[4-(cyclopropylmethylamino)piperidin-1-yl]-[5-(4-methoxyphenyl)-3-pyridinyl]methanone;dihydrochloride
CID 119622551
N-cyclopropyl-5-(4-phenylphenyl)pyridine-3-carboxamide
CID 42845850
[4-(methylamino)piperidin-1-yl]-(3-phenyl-1,2-oxazol-5-yl)methanone;hydrochloride
CID 119563333
(3-hydroxyphenyl)-[4-(methylamino)piperidin-1-yl]methanone
CID 60818037
(3,4-dichlorophenyl)-[4-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119559758
[5-(4-chlorophenyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 42845797
[5-[4-(dimethylamino)phenyl]-3-pyridinyl]-[4-(ethylaminomethyl)piperidin-1-yl]methanone;dihydrochloride
CID 119648513

Frequently Asked Questions

What is the IUPAC name of [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone?
The IUPAC name of [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone (CID 119561943) is [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone.
What is the SMILES notation for [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone?
The canonical SMILES for [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone is CNC1CCN(C(=O)c2cncc(-c3ccccc3)c2)CC1.
What is the InChIKey of [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone?
The InChIKey is TZWMQWUDFPCXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-19-17-7-9-21(10-8-17)18(22)16-11-15(12-20-13-16)14-5-3-2-4-6-14/h2-6,11-13,17,19H,7-10H2,1H3.
What are the key properties of [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone?
[4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone has a molecular weight of 295.39 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methylamino)piperidin-1-yl]-(5-phenyl-3-pyridinyl)methanone is sourced from PubChem (CID 119561943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).