4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide

C17H24N2O2 — CID 106781123

IUPAC4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CC(CC2CCOc3ccccc32)CCN1
InChIInChI=1S/C17H24N2O2/c1-18-17(20)15-11-12(6-8-19-15)10-13-7-9-21-16-5-3-2-4-14(13)16/h2-5,12-13,15,19H,6-11H2,1H3,(H,18,20)
InChIKeyBWJSUVIVHYNIEY-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.06
Rot. Bonds3

About 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide

4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide (PubChem CID 106781123) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide
PubChem CID106781123
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CC(CC2CCOc3ccccc32)CCN1
InChIInChI=1S/C17H24N2O2/c1-18-17(20)15-11-12(6-8-19-15)10-13-7-9-21-16-5-3-2-4-14(13)16/h2-5,12-13,15,19H,6-11H2,1H3,(H,18,20)
InChIKeyBWJSUVIVHYNIEY-UHFFFAOYSA-N
XLogP2.06
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide 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

1-(3,4-dihydro-2H-chromen-4-yl)-3-piperidin-4-ylpropan-2-one
CID 116559906
1-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperazine-2-carboxamide
CID 104769023
3-(3,4-dihydro-2H-chromen-4-ylmethyl)cycloheptan-1-amine
CID 104771828
2-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclobutane-1-carboxylic acid
CID 104772491
1-(3,4-dihydro-2H-chromen-4-yl)propan-2-one
CID 14203080
1-(3,4-dihydro-2H-chromen-4-yl)-N-methylmethanamine;hydrochloride
CID 165145525
5-(3,4-dihydro-2H-chromen-4-ylmethyl)pyrrolidine-2-carboxylic acid
CID 104771276
N-(3,4-dihydro-2H-chromen-4-ylmethyl)acetamide
CID 110709223
N-(2-methylpiperidin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide
CID 106995393
1-cyclopropyl-N-(3,4-dihydro-2H-chromen-4-ylmethyl)methanamine
CID 63708653
1-(3,4-dihydro-2H-chromen-4-yl)pentan-2-one
CID 104769754
1-cyclobutyl-3-(3,4-dihydro-2H-chromen-4-yl)-N-methylpropan-2-amine
CID 103169448

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide?
The IUPAC name of 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide (CID 106781123) is 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide?
The canonical SMILES for 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide is CNC(=O)C1CC(CC2CCOc3ccccc32)CCN1.
What is the InChIKey of 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide?
The InChIKey is BWJSUVIVHYNIEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-18-17(20)15-11-12(6-8-19-15)10-13-7-9-21-16-5-3-2-4-14(13)16/h2-5,12-13,15,19H,6-11H2,1H3,(H,18,20).
What are the key properties of 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide?
4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 106781123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).