6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine

C13H17NO — CID 19107088

IUPAC6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine
SMILESNC12CCCCC1COc1ccccc12
InChIInChI=1S/C13H17NO/c14-13-8-4-3-5-10(13)9-15-12-7-2-1-6-11(12)13/h1-2,6-7,10H,3-5,8-9,14H2
InChIKeyASLGWVDYLHTOPR-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.42
Rot. Bonds

About 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine

6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine (PubChem CID 19107088) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine.

Molecular Properties

Compound Name6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine
PubChem CID19107088
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC Name6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine
SMILESNC12CCCCC1COc1ccccc12
InChIInChI=1S/C13H17NO/c14-13-8-4-3-5-10(13)9-15-12-7-2-1-6-11(12)13/h1-2,6-7,10H,3-5,8-9,14H2
InChIKeyASLGWVDYLHTOPR-UHFFFAOYSA-N
XLogP2.42
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9H-Xanthene-9-methanamine
CID 15645577
9H-Xanthen-9-amine
CID 602451
10AH-Dibenzo[B,D]pyran-10A-amine, 6,6A,7,8,9,10-
CID 19106956
N-methyl-6,6a,7,10-tetrahydrobenzo[c]chromen-10a-amine
CID 19107059
(3S,4S)-4-ethyl-3-methyl-6-phenyl-2,4-dihydrochromen-3-amine
CID 148302367
(3S,4S)-4-ethyl-3,6-dimethyl-2,4-dihydrochromen-3-amine
CID 153287572
(S)-6-Fluorochroman-4-amine
CID 46911904
3,4-Dihydro-2H-1-benzopyran-4-amine
CID 4961957
6,6a,7,10-Tetrahydrobenzo[c]chromen-10a-amine
CID 19107081
1-(2-Methoxyphenyl)cyclohexylamine
CID 24273789
1-(2-Methoxyphenyl)cyclohexan-1-amine;hydrochloride
CID 45259886
6H-Dibenzo(b,d)pyran-6-methanamine
CID 3068349

Frequently Asked Questions

What is the IUPAC name of 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine?
The IUPAC name of 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine (CID 19107088) is 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine.
What is the SMILES notation for 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine?
The canonical SMILES for 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine is NC12CCCCC1COc1ccccc12.
What is the InChIKey of 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine?
The InChIKey is ASLGWVDYLHTOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c14-13-8-4-3-5-10(13)9-15-12-7-2-1-6-11(12)13/h1-2,6-7,10H,3-5,8-9,14H2.
What are the key properties of 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine?
6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine has a molecular weight of 203.29 g/mol, XLogP of 2.42, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6a,7,8,9,10-hexahydrobenzo[c]chromen-10a-amine is sourced from PubChem (CID 19107088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).