2-(2,2,7-trimethylchromen-6-yl)propan-1-amine

C15H21NO — CID 117096976

IUPAC2-(2,2,7-trimethylchromen-6-yl)propan-1-amine
SMILESCc1cc2c(cc1C(C)CN)C=CC(C)(C)O2
InChIInChI=1S/C15H21NO/c1-10-7-14-12(5-6-15(3,4)17-14)8-13(10)11(2)9-16/h5-8,11H,9,16H2,1-4H3
InChIKeyOBEPGQAXIVEQHA-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.24
Rot. Bonds2

About 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine

2-(2,2,7-trimethylchromen-6-yl)propan-1-amine (PubChem CID 117096976) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine.

Molecular Properties

Compound Name2-(2,2,7-trimethylchromen-6-yl)propan-1-amine
PubChem CID117096976
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name2-(2,2,7-trimethylchromen-6-yl)propan-1-amine
SMILESCc1cc2c(cc1C(C)CN)C=CC(C)(C)O2
InChIInChI=1S/C15H21NO/c1-10-7-14-12(5-6-15(3,4)17-14)8-13(10)11(2)9-16/h5-8,11H,9,16H2,1-4H3
InChIKeyOBEPGQAXIVEQHA-UHFFFAOYSA-N
XLogP3.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-6-(1-methoxyethyl)-2,2-dimethylchromene
CID 14427467
N-(diaminomethylidene)-2,2,7-trimethylchromene-6-carboxamide
CID 146032606
2,2,7-trimethylchromene
CID 12934382
2-(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propan-1-amine
CID 117316293
2-phenyl-N-(2,2,7-trimethylchromen-6-yl)propanamide
CID 54176266
2,2-dimethylbenzo[g]chromene
CID 1218933
7-methoxy-2,2-dimethyl-6-propan-2-yloxychromene
CID 15390937
2-(2,3,4,5-tetramethylphenyl)propan-1-amine
CID 117282734
(1R,2S)-1-(2,2-dimethylchromen-6-yl)propane-1,2-diol
CID 146682719
N-[2-(2,2-dimethylchromen-6-yl)ethyl]propan-2-amine;hydrochloride
CID 46918543
[(1S)-1-(7-methoxy-2,2-dimethylchromen-6-yl)ethyl] (Z)-2-methylbut-2-enoate
CID 163186665
2-[5-(difluoromethyl)-2-methylphenyl]propan-1-amine
CID 117288683

Frequently Asked Questions

What is the IUPAC name of 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine?
The IUPAC name of 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine (CID 117096976) is 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine.
What is the SMILES notation for 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine?
The canonical SMILES for 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine is Cc1cc2c(cc1C(C)CN)C=CC(C)(C)O2.
What is the InChIKey of 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine?
The InChIKey is OBEPGQAXIVEQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-10-7-14-12(5-6-15(3,4)17-14)8-13(10)11(2)9-16/h5-8,11H,9,16H2,1-4H3.
What are the key properties of 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine?
2-(2,2,7-trimethylchromen-6-yl)propan-1-amine has a molecular weight of 231.34 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,7-trimethylchromen-6-yl)propan-1-amine is sourced from PubChem (CID 117096976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).