[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine

C10H13NO — CID 51887493

IUPAC[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
SMILESNC[C@@H]1CCOc2ccccc21
InChIInChI=1S/C10H13NO/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1-4,8H,5-7,11H2/t8-/m0/s1
InChIKeyXGFJPMBRXFFNAH-QMMMGPOBSA-N
MW163.22 g/mol
LogP1.51
Rot. Bonds1

About [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine

[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine (PubChem CID 51887493) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine.

Molecular Properties

Compound Name[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
PubChem CID51887493
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
SMILESNC[C@@H]1CCOc2ccccc21
InChIInChI=1S/C10H13NO/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1-4,8H,5-7,11H2/t8-/m0/s1
InChIKeyXGFJPMBRXFFNAH-QMMMGPOBSA-N
XLogP1.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(4S)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887495
2-(3,4-dihydro-2H-chromen-4-yl)ethanamine;hydrochloride
CID 175798234
(4R)-4-(iodomethyl)-3,4-dihydro-2H-chromene
CID 92908096
3-(3,4-dihydro-2H-chromen-4-yl)-2-fluoropropan-1-amine
CID 104772597
[1-(3,4-dihydro-2H-chromen-4-ylmethyl)azetidin-3-yl]methanamine
CID 113451461
ethane;4-ethyl-3,4-dihydro-2H-chromene
CID 169111717
4-(3,4-dihydro-2H-chromen-4-yl)-3-fluorobutan-1-amine
CID 104772612
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
3-(3,4-dihydro-2H-chromen-4-yl)propanal
CID 104771097
1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine
CID 83910100
[2-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-ethylcyclohexyl]methanamine
CID 104772516

Frequently Asked Questions

What is the IUPAC name of [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine?
The IUPAC name of [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine (CID 51887493) is [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine.
What is the SMILES notation for [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine?
The canonical SMILES for [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine is NC[C@@H]1CCOc2ccccc21.
What is the InChIKey of [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine?
The InChIKey is XGFJPMBRXFFNAH-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H13NO/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1-4,8H,5-7,11H2/t8-/m0/s1.
What are the key properties of [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine?
[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine has a molecular weight of 163.22 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine is sourced from PubChem (CID 51887493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).