N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine

C12H17NO — CID 83907392

IUPACN-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine
SMILESCNCC1CCOc2ccc(C)cc21
InChIInChI=1S/C12H17NO/c1-9-3-4-12-11(7-9)10(8-13-2)5-6-14-12/h3-4,7,10,13H,5-6,8H2,1-2H3
InChIKeyNANDGUKJOZZXGO-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.08
Rot. Bonds2

About N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine

N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine (PubChem CID 83907392) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine
PubChem CID83907392
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC NameN-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine
SMILESCNCC1CCOc2ccc(C)cc21
InChIInChI=1S/C12H17NO/c1-9-3-4-12-11(7-9)10(8-13-2)5-6-14-12/h3-4,7,10,13H,5-6,8H2,1-2H3
InChIKeyNANDGUKJOZZXGO-UHFFFAOYSA-N
XLogP2.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dihydro-2H-chromen-4-yl)-N-methylmethanamine;hydrochloride
CID 165145525
1-(7-chloro-3,4-dihydro-2H-chromen-4-yl)-N-methylmethanamine
CID 54133919
3-[(6-methyl-3,4-dihydro-2H-chromen-4-yl)methyl]-1H-pyrrole
CID 143737496
(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene
CID 167327532
N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine
CID 81482054
[(4R)-6-methyl-3,4-dihydro-2H-chromen-4-yl] acetate
CID 102427933
1-[7-(benzenesulfonyl)-3,4-dihydro-2H-chromen-4-yl]-N-methylmethanamine
CID 11544229
2,2,2-trichloro-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)acetamide
CID 108734077
2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)acetaldehyde
CID 87790896
ethane;3-[(6-methyl-3,4-dihydro-2H-chromen-4-yl)methyl]-1H-pyrrole;pentan-2-one
CID 143737535
2-bromo-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)butanamide
CID 108734108
N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methylbenzamide
CID 110709241

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine?
The IUPAC name of N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine (CID 83907392) is N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine is CNCC1CCOc2ccc(C)cc21.
What is the InChIKey of N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine?
The InChIKey is NANDGUKJOZZXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-9-3-4-12-11(7-9)10(8-13-2)5-6-14-12/h3-4,7,10,13H,5-6,8H2,1-2H3.
What are the key properties of N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine?
N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine has a molecular weight of 191.27 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine is sourced from PubChem (CID 83907392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).