N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine

C19H25NO — CID 10265863

IUPACN,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine
SMILESCCCN(CCC)C1COc2ccc3ccccc3c2C1
InChIInChI=1S/C19H25NO/c1-3-11-20(12-4-2)16-13-18-17-8-6-5-7-15(17)9-10-19(18)21-14-16/h5-10,16H,3-4,11-14H2,1-2H3
InChIKeyDKPLHRMZPXJGSC-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.27
Rot. Bonds5

About N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine

N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine (PubChem CID 10265863) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine.

Molecular Properties

Compound NameN,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine
PubChem CID10265863
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC NameN,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine
SMILESCCCN(CCC)C1COc2ccc3ccccc3c2C1
InChIInChI=1S/C19H25NO/c1-3-11-20(12-4-2)16-13-18-17-8-6-5-7-15(17)9-10-19(18)21-14-16/h5-10,16H,3-4,11-14H2,1-2H3
InChIKeyDKPLHRMZPXJGSC-UHFFFAOYSA-N
XLogP4.27
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine?
The IUPAC name of N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine (CID 10265863) is N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine.
What is the SMILES notation for N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine?
The canonical SMILES for N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine is CCCN(CCC)C1COc2ccc3ccccc3c2C1.
What is the InChIKey of N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine?
The InChIKey is DKPLHRMZPXJGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-11-20(12-4-2)16-13-18-17-8-6-5-7-15(17)9-10-19(18)21-14-16/h5-10,16H,3-4,11-14H2,1-2H3.
What are the key properties of N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine?
N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine has a molecular weight of 283.41 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine is sourced from PubChem (CID 10265863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).