N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine

C18H22N2 — CID 62513614

IUPACN-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine
SMILESc1ccc2cc(N3CCC(CNC4CC4)C3)ccc2c1
InChIInChI=1S/C18H22N2/c1-2-4-16-11-18(8-5-15(16)3-1)20-10-9-14(13-20)12-19-17-6-7-17/h1-5,8,11,14,17,19H,6-7,9-10,12-13H2
InChIKeyIFGZESJXNFYEDU-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.42
Rot. Bonds4

About N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine

N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine (PubChem CID 62513614) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine
PubChem CID62513614
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC NameN-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine
SMILESc1ccc2cc(N3CCC(CNC4CC4)C3)ccc2c1
InChIInChI=1S/C18H22N2/c1-2-4-16-11-18(8-5-15(16)3-1)20-10-9-14(13-20)12-19-17-6-7-17/h1-5,8,11,14,17,19H,6-7,9-10,12-13H2
InChIKeyIFGZESJXNFYEDU-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(1-naphthalen-2-ylpyrrolidin-3-yl)methanamine
CID 62513770
N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]ethanamine
CID 62513771
N-[[1-(4-iodophenyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 55081197
N-[[1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 62513515
N-[[1-(4-bromo-3-methylphenyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 62513701
N-[[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 62513359
N-[[1-[4-bromo-3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]methyl]cyclopropanamine
CID 64854781
2-[3-[(cyclopropylamino)methyl]pyrrolidin-1-yl]-N,N-dimethylaniline
CID 106760054
N-[[1-(6-bromonaphthalen-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 81266805
N-[[1-(2,4-dibromophenyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 62511468
2-methyl-5-[3-[[(1-phenylpiperidin-4-yl)amino]methyl]pyrrolidin-1-yl]pyridazin-3-one
CID 45252002
N-[[1-(3-bromoquinolin-8-yl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 116784963

Frequently Asked Questions

What is the IUPAC name of N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine (CID 62513614) is N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine is c1ccc2cc(N3CCC(CNC4CC4)C3)ccc2c1.
What is the InChIKey of N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine?
The InChIKey is IFGZESJXNFYEDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-2-4-16-11-18(8-5-15(16)3-1)20-10-9-14(13-20)12-19-17-6-7-17/h1-5,8,11,14,17,19H,6-7,9-10,12-13H2.
What are the key properties of N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine?
N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine has a molecular weight of 266.39 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-naphthalen-2-ylpyrrolidin-3-yl)methyl]cyclopropanamine is sourced from PubChem (CID 62513614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).