4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide

C15H22N2O2 — CID 115157512

IUPAC4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide
SMILESCC(C)(N)CCC(=O)Nc1ccc2c(c1)CCCO2
InChIInChI=1S/C15H22N2O2/c1-15(2,16)8-7-14(18)17-12-5-6-13-11(10-12)4-3-9-19-13/h5-6,10H,3-4,7-9,16H2,1-2H3,(H,17,18)
InChIKeyNXKUMSURNIFLCZ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.47
Rot. Bonds4

About 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide

4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide (PubChem CID 115157512) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide.

Molecular Properties

Compound Name4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide
PubChem CID115157512
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide
SMILESCC(C)(N)CCC(=O)Nc1ccc2c(c1)CCCO2
InChIInChI=1S/C15H22N2O2/c1-15(2,16)8-7-14(18)17-12-5-6-13-11(10-12)4-3-9-19-13/h5-6,10H,3-4,7-9,16H2,1-2H3,(H,17,18)
InChIKeyNXKUMSURNIFLCZ-UHFFFAOYSA-N
XLogP2.47
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-4-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)pentanamide
CID 115157489
7-amino-N-(3,4-dihydro-2H-chromen-6-yl)heptanamide
CID 119767333
N-(3,4-dihydro-2H-chromen-6-yl)-2-sulfanylacetamide
CID 115166948
1-tert-butyl-3-(3,4-dihydro-2H-chromen-6-yl)urea
CID 110748414
N-(3,4-dihydro-2H-chromen-6-yl)carbamoyl bromide
CID 115193294
3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide
CID 34439811
N-(3,4-dihydro-2H-chromen-6-yl)-2-phenoxyacetamide
CID 110726178
N-(3,4-dihydro-2H-chromen-6-yl)-2-hydroxypropanamide
CID 115140407
1-N-(3,4-dihydro-2H-chromen-6-ylmethyl)-1-N,3-dimethylbutane-1,3-diamine
CID 115200729
7-amino-N-(2,3-dihydro-1-benzofuran-5-yl)heptanamide;hydrochloride
CID 119728510
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxopentanamide
CID 60638238
3-cyano-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide
CID 115173560

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide?
The IUPAC name of 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide (CID 115157512) is 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide.
What is the SMILES notation for 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide?
The canonical SMILES for 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide is CC(C)(N)CCC(=O)Nc1ccc2c(c1)CCCO2.
What is the InChIKey of 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide?
The InChIKey is NXKUMSURNIFLCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-15(2,16)8-7-14(18)17-12-5-6-13-11(10-12)4-3-9-19-13/h5-6,10H,3-4,7-9,16H2,1-2H3,(H,17,18).
What are the key properties of 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide?
4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide has a molecular weight of 262.35 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3,4-dihydro-2H-chromen-6-yl)-4-methylpentanamide is sourced from PubChem (CID 115157512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).