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

C14H19NO — CID 83910100

IUPAC1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine
SMILESNC1(CCC2CCOc3ccccc32)CC1
InChIInChI=1S/C14H19NO/c15-14(8-9-14)7-5-11-6-10-16-13-4-2-1-3-12(11)13/h1-4,11H,5-10,15H2
InChIKeyDEMYPWPBFIMGEG-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.82
Rot. Bonds3

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

1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine (PubChem CID 83910100) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine
PubChem CID83910100
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine
SMILESNC1(CCC2CCOc3ccccc32)CC1
InChIInChI=1S/C14H19NO/c15-14(8-9-14)7-5-11-6-10-16-13-4-2-1-3-12(11)13/h1-4,11H,5-10,15H2
InChIKeyDEMYPWPBFIMGEG-UHFFFAOYSA-N
XLogP2.82
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dihydro-2H-chromen-4-yl)ethanamine;hydrochloride
CID 175798234
[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887493
[(4S)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887495
1-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 104769683
3-(3,4-dihydro-2H-chromen-4-yl)propanal
CID 104771097
(4R)-4-(iodomethyl)-3,4-dihydro-2H-chromene
CID 92908096
4-(3,4-dihydro-2H-chromen-4-yl)-1-iodobutan-1-amine
CID 118889673
1-(2,3-dihydro-1-benzofuran-3-ylmethyl)cyclopropan-1-amine
CID 79220094
ethane;4-ethyl-3,4-dihydro-2H-chromene
CID 169111717
1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol
CID 104769122
4-(3,4-dihydro-2H-chromen-4-yl)butanoic acid
CID 104772494
3-cyclopropyl-1-(3,4-dihydro-2H-chromen-4-ylmethyl)azetidin-3-amine
CID 104771510

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine (CID 83910100) is 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine is NC1(CCC2CCOc3ccccc32)CC1.
What is the InChIKey of 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine?
The InChIKey is DEMYPWPBFIMGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c15-14(8-9-14)7-5-11-6-10-16-13-4-2-1-3-12(11)13/h1-4,11H,5-10,15H2.
What are the key properties of 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine?
1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine has a molecular weight of 217.31 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 83910100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).