N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine

C16H18N2O — CID 134793852

IUPACN-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
SMILESCN(Cc1ccccn1)C1CCOc2ccccc21
InChIInChI=1S/C16H18N2O/c1-18(12-13-6-4-5-10-17-13)15-9-11-19-16-8-3-2-7-14(15)16/h2-8,10,15H,9,11-12H2,1H3
InChIKeyHWLIGVFHCKBBEY-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.04
Rot. Bonds3

About N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine

N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine (PubChem CID 134793852) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound NameN-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
PubChem CID134793852
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
SMILESCN(Cc1ccccn1)C1CCOc2ccccc21
InChIInChI=1S/C16H18N2O/c1-18(12-13-6-4-5-10-17-13)15-9-11-19-16-8-3-2-7-14(15)16/h2-8,10,15H,9,11-12H2,1H3
InChIKeyHWLIGVFHCKBBEY-UHFFFAOYSA-N
XLogP3.04
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(4-methylphenyl)methyl]-3,4-dihydro-2H-chromen-4-amine
CID 134791910
N-(cyclohexylmethyl)-N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 134794851
2-(3,4-dihydro-2H-chromen-4-yl)-N-methyl-1-pyridin-2-ylethanamine
CID 104770144
2-(aminomethyl)-N-methyl-N-(pyridin-2-ylmethyl)cyclobutan-1-amine
CID 80999490
N-methyl-N-(piperidin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
CID 106623158
1-(3,4-dihydro-2H-chromen-4-ylmethyl)-2-methyl-3-(pyridin-2-ylmethyl)guanidine;hydroiodide
CID 111547360
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
3-N-methyl-3-N-(pyridin-2-ylmethyl)cyclopentane-1,3-diamine
CID 79469541
N-(3,4-dihydro-2H-chromen-4-yl)-2-methoxy-N-methylacetamide
CID 134794474
N-methyl-1-(oxiran-2-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 43564926
ethane;N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 143399161

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine (CID 134793852) is N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine is CN(Cc1ccccn1)C1CCOc2ccccc21.
What is the InChIKey of N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is HWLIGVFHCKBBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-18(12-13-6-4-5-10-17-13)15-9-11-19-16-8-3-2-7-14(15)16/h2-8,10,15H,9,11-12H2,1H3.
What are the key properties of N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine?
N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 254.33 g/mol, XLogP of 3.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyridin-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 134793852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).