N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine

C20H19FN2 — CID 55503066

IUPACN-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine
SMILESFc1ccccc1CN(Cc1cccc2cccnc12)C1CC1
InChIInChI=1S/C20H19FN2/c21-19-9-2-1-5-16(19)13-23(18-10-11-18)14-17-7-3-6-15-8-4-12-22-20(15)17/h1-9,12,18H,10-11,13-14H2
InChIKeyYBZVRRRTPGHXOS-UHFFFAOYSA-N
MW306.38 g/mol
LogP4.54
Rot. Bonds5

About N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine

N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine (PubChem CID 55503066) has the molecular formula C20H19FN2 and a molecular weight of 306.38 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine
PubChem CID55503066
Molecular FormulaC20H19FN2
Molecular Weight306.38 g/mol
Exact Mass306.15
IUPAC NameN-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine
SMILESFc1ccccc1CN(Cc1cccc2cccnc12)C1CC1
InChIInChI=1S/C20H19FN2/c21-19-9-2-1-5-16(19)13-23(18-10-11-18)14-17-7-3-6-15-8-4-12-22-20(15)17/h1-9,12,18H,10-11,13-14H2
InChIKeyYBZVRRRTPGHXOS-UHFFFAOYSA-N
XLogP4.54
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclopropyl(quinolin-8-ylmethyl)amino]ethanol
CID 60510570
2-[cyclopentyl(quinolin-8-ylmethyl)amino]ethanol
CID 60912446
3-[cyclobutyl(quinolin-8-ylmethyl)amino]propan-1-ol
CID 102848366
3-[cyclopropyl(quinolin-8-ylmethyl)amino]-N'-hydroxypropanimidamide
CID 76911837
1-N,4-N-dimethyl-4-N-(quinolin-8-ylmethyl)cyclohexane-1,4-diamine
CID 79117135
N-[(2-fluorophenyl)methyl]-N-(2-pyridin-4-ylethyl)cyclopropanamine
CID 86909109
N-(cyclopentylmethyl)-N-[(2-fluorophenyl)methyl]cyclopropanamine
CID 112828716
2-[cyclobutyl-[(6-fluoroquinolin-8-yl)methyl]amino]ethanol
CID 102677075
N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-N-[(2-fluorophenyl)methyl]cyclobutanamine
CID 71920109
1-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-methylpropan-2-ol
CID 110932461
N-(furan-2-ylmethyl)-1,1-dioxo-N-(quinolin-8-ylmethyl)thiolan-3-amine
CID 18154589
N-ethyl-N-(quinolin-8-ylmethyl)ethanamine
CID 2320167

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine?
The IUPAC name of N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine (CID 55503066) is N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine is Fc1ccccc1CN(Cc1cccc2cccnc12)C1CC1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine?
The InChIKey is YBZVRRRTPGHXOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2/c21-19-9-2-1-5-16(19)13-23(18-10-11-18)14-17-7-3-6-15-8-4-12-22-20(15)17/h1-9,12,18H,10-11,13-14H2.
What are the key properties of N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine?
N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine has a molecular weight of 306.38 g/mol, XLogP of 4.54, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-N-(quinolin-8-ylmethyl)cyclopropanamine is sourced from PubChem (CID 55503066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).