N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine

C14H22N2 — CID 63820570

IUPACN-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine
SMILESCC(NCC1(C)CCCC1)c1ccncc1
InChIInChI=1S/C14H22N2/c1-12(13-5-9-15-10-6-13)16-11-14(2)7-3-4-8-14/h5-6,9-10,12,16H,3-4,7-8,11H2,1-2H3
InChIKeyCNMOQKPRJOWWDV-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.31
Rot. Bonds4

About N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine

N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine (PubChem CID 63820570) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine.

Molecular Properties

Compound NameN-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine
PubChem CID63820570
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine
SMILESCC(NCC1(C)CCCC1)c1ccncc1
InChIInChI=1S/C14H22N2/c1-12(13-5-9-15-10-6-13)16-11-14(2)7-3-4-8-14/h5-6,9-10,12,16H,3-4,7-8,11H2,1-2H3
InChIKeyCNMOQKPRJOWWDV-UHFFFAOYSA-N
XLogP3.31
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-methylcyclopentyl)methyl]-1-pyridin-3-ylethanamine
CID 63821311
[1-[[[(1R)-1-pyridin-4-ylethyl]amino]methyl]cyclohexyl]methanol
CID 81419096
N-[(1-methylcyclopentyl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine
CID 63822061
N-[(1-methylsulfanylcyclobutyl)methyl]-1-pyridin-4-ylethanamine
CID 107266129
1-(4-ethoxyphenyl)-N-[(1-methylcyclobutyl)methyl]ethanamine
CID 103903167
N-[(1-methylcyclopentyl)methyl]-1-naphthalen-2-ylethanamine
CID 63821863
2-[1-[(1-pyridin-4-ylethylamino)methyl]cyclopropyl]acetonitrile
CID 65480567
1-(4-imidazol-1-ylphenyl)-N-[(1-methylcyclopropyl)methyl]ethanamine
CID 103902853
N-[(4-methyloxan-4-yl)methyl]-1-phenylethanamine
CID 103742213
5-[1-[(1-methylcyclopentyl)methylamino]ethyl]-1,3-dihydrobenzimidazol-2-one
CID 63822548
1-(2,6-dichloro-3-fluorophenyl)-N-[(1-methylcyclopentyl)methyl]ethanamine
CID 55259288
(1R)-N-[1-(1-methylcyclopropyl)ethyl]-1-pyridin-4-ylethanamine
CID 81405399

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine?
The IUPAC name of N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine (CID 63820570) is N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine.
What is the SMILES notation for N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine?
The canonical SMILES for N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine is CC(NCC1(C)CCCC1)c1ccncc1.
What is the InChIKey of N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine?
The InChIKey is CNMOQKPRJOWWDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-12(13-5-9-15-10-6-13)16-11-14(2)7-3-4-8-14/h5-6,9-10,12,16H,3-4,7-8,11H2,1-2H3.
What are the key properties of N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine?
N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine has a molecular weight of 218.34 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclopentyl)methyl]-1-pyridin-4-ylethanamine is sourced from PubChem (CID 63820570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).