1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine

C14H20N2O — CID 116961239

IUPAC1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine
SMILESCNC(c1ccc2c(c1)CCCO2)C1(N)CC1
InChIInChI=1S/C14H20N2O/c1-16-13(14(15)6-7-14)11-4-5-12-10(9-11)3-2-8-17-12/h4-5,9,13,16H,2-3,6-8,15H2,1H3
InChIKeyCFQPNSDKDRPRGN-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.76
Rot. Bonds3

About 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine

1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine (PubChem CID 116961239) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine
PubChem CID116961239
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine
SMILESCNC(c1ccc2c(c1)CCCO2)C1(N)CC1
InChIInChI=1S/C14H20N2O/c1-16-13(14(15)6-7-14)11-4-5-12-10(9-11)3-2-8-17-12/h4-5,9,13,16H,2-3,6-8,15H2,1H3
InChIKeyCFQPNSDKDRPRGN-UHFFFAOYSA-N
XLogP1.76
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclobutane-1-carbonitrile
CID 116958684
1-(2,3-dihydro-1-benzofuran-5-yl)-1-(1-methoxycyclohexyl)-N-methylmethanamine
CID 116763076
1-(3,5-dibromophenyl)-1-(3,4-dihydro-2H-chromen-6-yl)-N-methylmethanamine
CID 107979805
1-(3,4-dihydro-2H-chromen-6-yl)-N,N'-dimethylpropane-1,3-diamine
CID 116948587
1-(3,4-dihydro-2H-chromen-6-yl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
CID 61027887
1-[4-(3,4-dihydro-2H-chromen-6-yl)phenyl]-N-methylethanamine
CID 61032925
1-[amino(3,4-dihydro-2H-chromen-6-yl)methyl]cyclobutane-1-carboxylic acid
CID 116944092
3,4-dihydro-2H-chromen-6-yl-(1-methylcyclohexyl)methanol
CID 106828329
methyl 2-(3,4-dihydro-2H-chromen-6-yl)-3-methylbutanoate
CID 116964483
1-(2,3-dihydro-1-benzofuran-5-yl)-N,N'-dimethylmethanediamine
CID 116954398
1-(3,4-dihydro-2H-chromen-6-yl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 61027481
2-amino-2-(3,4-dihydro-2H-chromen-6-yl)-N'-methylacetohydrazide
CID 116849405

Frequently Asked Questions

What is the IUPAC name of 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine?
The IUPAC name of 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine (CID 116961239) is 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine?
The canonical SMILES for 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine is CNC(c1ccc2c(c1)CCCO2)C1(N)CC1.
What is the InChIKey of 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine?
The InChIKey is CFQPNSDKDRPRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-16-13(14(15)6-7-14)11-4-5-12-10(9-11)3-2-8-17-12/h4-5,9,13,16H,2-3,6-8,15H2,1H3.
What are the key properties of 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine?
1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine has a molecular weight of 232.33 g/mol, XLogP of 1.76, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3,4-dihydro-2H-chromen-6-yl(methylamino)methyl]cyclopropan-1-amine is sourced from PubChem (CID 116961239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).