N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine

C13H17NO — CID 43190759

IUPACN-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine
SMILESc1ccc2c(c1)OCCC2NCC1CC1
InChIInChI=1S/C13H17NO/c1-2-4-13-11(3-1)12(7-8-15-13)14-9-10-5-6-10/h1-4,10,12,14H,5-9H2
InChIKeyIFKVYIJOSBRPBC-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.51
Rot. Bonds3

About N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine

N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine (PubChem CID 43190759) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine
PubChem CID43190759
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC NameN-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine
SMILESc1ccc2c(c1)OCCC2NCC1CC1
InChIInChI=1S/C13H17NO/c1-2-4-13-11(3-1)12(7-8-15-13)14-9-10-5-6-10/h1-4,10,12,14H,5-9H2
InChIKeyIFKVYIJOSBRPBC-UHFFFAOYSA-N
XLogP2.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(cyclopropylmethoxy)propyl]-3,4-dihydro-2H-chromen-4-amine
CID 43206794
1-cyclopropyl-N-(3,4-dihydro-2H-chromen-4-ylmethyl)methanamine
CID 63708653
2-(3,4-dihydro-2H-chromen-4-ylamino)acetonitrile
CID 62367299
(4R)-N-(3-methoxypropyl)-3,4-dihydro-2H-chromen-4-amine
CID 7287154
(4R)-N-iodo-3,4-dihydro-2H-chromen-4-amine
CID 163411426
N'-cyclopropyl-N-(3,4-dihydro-2H-chromen-4-yl)-N'-methylethane-1,2-diamine
CID 62977569
(4S)-N-(3,3-dimethylbutyl)-3,4-dihydro-2H-chromen-4-amine
CID 94276035
N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
CID 102897194
N-[(5-methylthiophen-2-yl)methyl]-3,4-dihydro-2H-chromen-4-amine
CID 43223509
N-(2-cyclopropylpropyl)-3,4-dihydro-2H-chromen-4-amine
CID 115713897
1-N-(3,4-dihydro-2H-chromen-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 54913047
N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-chromen-4-amine
CID 43221297

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine (CID 43190759) is N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine is c1ccc2c(c1)OCCC2NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is IFKVYIJOSBRPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-2-4-13-11(3-1)12(7-8-15-13)14-9-10-5-6-10/h1-4,10,12,14H,5-9H2.
What are the key properties of N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine?
N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 203.28 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 43190759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).