N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine

C15H18N2 — CID 105157242

IUPACN-[cyclopropyl(quinolin-4-yl)methyl]ethanamine
SMILESCCNC(c1ccnc2ccccc12)C1CC1
InChIInChI=1S/C15H18N2/c1-2-16-15(11-7-8-11)13-9-10-17-14-6-4-3-5-12(13)14/h3-6,9-11,15-16H,2,7-8H2,1H3
InChIKeyZFZCPYFXRUZKFF-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.30
Rot. Bonds4

About N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine

N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine (PubChem CID 105157242) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopropyl(quinolin-4-yl)methyl]ethanamine
PubChem CID105157242
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-[cyclopropyl(quinolin-4-yl)methyl]ethanamine
SMILESCCNC(c1ccnc2ccccc12)C1CC1
InChIInChI=1S/C15H18N2/c1-2-16-15(11-7-8-11)13-9-10-17-14-6-4-3-5-12(13)14/h3-6,9-11,15-16H,2,7-8H2,1H3
InChIKeyZFZCPYFXRUZKFF-UHFFFAOYSA-N
XLogP3.30
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[oxan-4-yl(quinolin-4-yl)methyl]propan-1-amine
CID 105147197
N-[(4-bromonaphthalen-1-yl)-cyclopropylmethyl]ethanamine
CID 79596933
N-[oxan-3-yl(quinolin-4-yl)methyl]propan-1-amine
CID 107138702
2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine
CID 116723731
N-[cyclopentyl(naphthalen-1-yl)methyl]ethanamine
CID 55187374
N-[pyrimidin-5-yl(quinolin-4-yl)methyl]ethanamine
CID 105119009
N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine
CID 105157241
N-[cyclopropyl-(2,3-dimethoxyphenyl)methyl]ethanamine
CID 105157205
(4-methylcyclohexyl)-quinolin-4-ylmethanol
CID 64749766
N-ethyl-2-pyridin-2-yl-1-quinolin-4-ylethanamine
CID 105158093
N-[(1-methylpyrazol-4-yl)-quinolin-4-ylmethyl]ethanamine
CID 105104643
N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine
CID 105146311

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine?
The IUPAC name of N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine (CID 105157242) is N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine?
The canonical SMILES for N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine is CCNC(c1ccnc2ccccc12)C1CC1.
What is the InChIKey of N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine?
The InChIKey is ZFZCPYFXRUZKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-2-16-15(11-7-8-11)13-9-10-17-14-6-4-3-5-12(13)14/h3-6,9-11,15-16H,2,7-8H2,1H3.
What are the key properties of N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine?
N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine has a molecular weight of 226.32 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine is sourced from PubChem (CID 105157242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).