(3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine

C9H10ClNO — CID 92966039

IUPAC(3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine
SMILESN[C@H]1COc2cc(Cl)ccc2C1
InChIInChI=1S/C9H10ClNO/c10-7-2-1-6-3-8(11)5-12-9(6)4-7/h1-2,4,8H,3,5,11H2/t8-/m1/s1
InChIKeySFCGCBIKHFWQOV-MRVPVSSYSA-N
MW183.64 g/mol
LogP1.60
Rot. Bonds

About (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine

(3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine (PubChem CID 92966039) has the molecular formula C9H10ClNO and a molecular weight of 183.64 g/mol. Its IUPAC name is (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine.

Molecular Properties

Compound Name(3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine
PubChem CID92966039
Molecular FormulaC9H10ClNO
Molecular Weight183.64 g/mol
Exact Mass183.05
IUPAC Name(3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine
SMILESN[C@H]1COc2cc(Cl)ccc2C1
InChIInChI=1S/C9H10ClNO/c10-7-2-1-6-3-8(11)5-12-9(6)4-7/h1-2,4,8H,3,5,11H2/t8-/m1/s1
InChIKeySFCGCBIKHFWQOV-MRVPVSSYSA-N
XLogP1.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-chloro-3,4-dihydro-2H-chromen-3-ol
CID 15110076
7-chloro-3,4-dihydro-2H-pyrano[3,2-c]pyridin-3-amine
CID 137480568
7-[(2,6-dichlorophenyl)methoxy]-3,4-dihydro-2H-chromen-3-amine
CID 129243893
7-chloro-3-isocyanato-3,4-dihydro-2H-chromene
CID 115026637
5-chloro-2,3-dihydro-1H-inden-2-amine;2,3-dihydro-1H-inden-2-amine
CID 167560808
(3S)-6-fluoro-3,4-dihydro-2H-chromen-3-amine
CID 51557186
(3S)-7-chloro-8-fluoro-3,4-dihydro-2H-chromen-3-amine
CID 137480705
1-(6-chloro-2,3-dihydro-1-benzofuran-2-yl)ethanamine
CID 54124385
[(2R)-6-chloro-2,3-dihydro-1-benzofuran-2-yl]methanol
CID 101091624
(3R,4R)-4-amino-6-chloro-3,4-dihydro-2H-chromen-3-ol
CID 71517079
6-chloro-2,3-dihydro-1-benzofuran-3-ol
CID 59606807
6-chloro-8-methoxy-3,4-dihydro-2H-chromen-3-amine
CID 86227477

Frequently Asked Questions

What is the IUPAC name of (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine?
The IUPAC name of (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine (CID 92966039) is (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine.
What is the SMILES notation for (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine?
The canonical SMILES for (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine is N[C@H]1COc2cc(Cl)ccc2C1.
What is the InChIKey of (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine?
The InChIKey is SFCGCBIKHFWQOV-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H10ClNO/c10-7-2-1-6-3-8(11)5-12-9(6)4-7/h1-2,4,8H,3,5,11H2/t8-/m1/s1.
What are the key properties of (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine?
(3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine has a molecular weight of 183.64 g/mol, XLogP of 1.60, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine is sourced from PubChem (CID 92966039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).