(8-propan-2-yl-2H-chromen-4-yl)methanamine

C13H17NO — CID 82277152

IUPAC(8-propan-2-yl-2H-chromen-4-yl)methanamine
SMILESCC(C)c1cccc2c1OCC=C2CN
InChIInChI=1S/C13H17NO/c1-9(2)11-4-3-5-12-10(8-14)6-7-15-13(11)12/h3-6,9H,7-8,14H2,1-2H3
InChIKeyBTTWCDDMTTXRHK-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.54
Rot. Bonds2

About (8-propan-2-yl-2H-chromen-4-yl)methanamine

(8-propan-2-yl-2H-chromen-4-yl)methanamine (PubChem CID 82277152) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is (8-propan-2-yl-2H-chromen-4-yl)methanamine.

Molecular Properties

Compound Name(8-propan-2-yl-2H-chromen-4-yl)methanamine
PubChem CID82277152
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name(8-propan-2-yl-2H-chromen-4-yl)methanamine
SMILESCC(C)c1cccc2c1OCC=C2CN
InChIInChI=1S/C13H17NO/c1-9(2)11-4-3-5-12-10(8-14)6-7-15-13(11)12/h3-6,9H,7-8,14H2,1-2H3
InChIKeyBTTWCDDMTTXRHK-UHFFFAOYSA-N
XLogP2.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (8-propan-2-yl-2H-chromen-4-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methyl-4-phenyl-8-propan-2-yl-2H-chromene
CID 132519298
6-propan-2-yl-4H-chromeno[4,3-d][1,3]thiazole
CID 141111505
(2-propan-2-ylphenyl)methanamine
CID 15040708
1,8-di(propan-2-yl)-9H-fluorene
CID 160592533
(1-methyl-4-propan-2-ylbenzimidazol-2-yl)methanamine
CID 84620078
2-(2-propan-2-ylphenyl)propan-1-amine
CID 82599641
1,3,5-tris[2,6-di(propan-2-yl)phenyl]-2,4,6-trimethyl-1,3,5,2,4,6-triazatrialuminane
CID 16714946
4-methyl-3-methylidene-8-propan-2-yl-1,4-benzoxazine
CID 167634223
ethane;6-propan-2-ylspiro[2,4-dihydro-1,5-benzodioxepine-3,1'-cyclopropane]
CID 165000926
(3R)-5-propan-2-yl-3,4-dihydro-2H-chromen-3-amine
CID 130607809
2,5-di(propan-2-yl)-2,3-dihydro-1,4-benzodioxine
CID 166819629
1-[2-(3,4-dihydro-2H-chromen-8-yl)phenyl]ethanamine
CID 114746628

Frequently Asked Questions

What is the IUPAC name of (8-propan-2-yl-2H-chromen-4-yl)methanamine?
The IUPAC name of (8-propan-2-yl-2H-chromen-4-yl)methanamine (CID 82277152) is (8-propan-2-yl-2H-chromen-4-yl)methanamine.
What is the SMILES notation for (8-propan-2-yl-2H-chromen-4-yl)methanamine?
The canonical SMILES for (8-propan-2-yl-2H-chromen-4-yl)methanamine is CC(C)c1cccc2c1OCC=C2CN.
What is the InChIKey of (8-propan-2-yl-2H-chromen-4-yl)methanamine?
The InChIKey is BTTWCDDMTTXRHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-9(2)11-4-3-5-12-10(8-14)6-7-15-13(11)12/h3-6,9H,7-8,14H2,1-2H3.
What are the key properties of (8-propan-2-yl-2H-chromen-4-yl)methanamine?
(8-propan-2-yl-2H-chromen-4-yl)methanamine has a molecular weight of 203.28 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-propan-2-yl-2H-chromen-4-yl)methanamine is sourced from PubChem (CID 82277152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).