N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine

C18H31N3 — CID 80638803

IUPACN-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine
SMILESCCNCc1cnc(N(CC(C)C)C2CCCC2)c(C)c1
InChIInChI=1S/C18H31N3/c1-5-19-11-16-10-15(4)18(20-12-16)21(13-14(2)3)17-8-6-7-9-17/h10,12,14,17,19H,5-9,11,13H2,1-4H3
InChIKeyFEOVIARSGJGVNU-UHFFFAOYSA-N
MW289.47 g/mol
LogP3.90
Rot. Bonds7

About N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine

N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine (PubChem CID 80638803) has the molecular formula C18H31N3 and a molecular weight of 289.47 g/mol. Its IUPAC name is N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine
PubChem CID80638803
Molecular FormulaC18H31N3
Molecular Weight289.47 g/mol
Exact Mass289.25
IUPAC NameN-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine
SMILESCCNCc1cnc(N(CC(C)C)C2CCCC2)c(C)c1
InChIInChI=1S/C18H31N3/c1-5-19-11-16-10-15(4)18(20-12-16)21(13-14(2)3)17-8-6-7-9-17/h10,12,14,17,19H,5-9,11,13H2,1-4H3
InChIKeyFEOVIARSGJGVNU-UHFFFAOYSA-N
XLogP3.90
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.47
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(chloromethyl)-N-cyclopropyl-3-methyl-N-(2-methylpropyl)pyridin-2-amine
CID 80629436
2-[cyclopentyl-[3-methyl-5-[(propan-2-ylamino)methyl]-2-pyridinyl]amino]ethanol
CID 80632565
5-(ethylaminomethyl)-N-(1-ethylpiperidin-4-yl)-N,3-dimethylpyridin-2-amine
CID 80639174
5-(aminomethyl)-N-cyclopentyl-N-ethyl-3-methylpyridin-2-amine
CID 80629924
[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol
CID 80631422
N-cyclopropyl-5-(ethylaminomethyl)-3-methyl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 80631053
N-butyl-N-cyclopropyl-3-methyl-5-(propylaminomethyl)pyridin-2-amine
CID 80629872
N-cyclohexyl-5-[(2-methoxyethylamino)methyl]-N,3-dimethylpyridin-2-amine
CID 80631236
2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide
CID 80629884
3-methyl-N-(2-methylpropyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyridin-2-amine
CID 80631917
N-cyclopropyl-N-(2-methoxyethyl)-3-methyl-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 80630602
N-(cyclopropylmethyl)-N-ethyl-3-methyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 80636161

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine?
The IUPAC name of N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine (CID 80638803) is N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine.
What is the SMILES notation for N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine?
The canonical SMILES for N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine is CCNCc1cnc(N(CC(C)C)C2CCCC2)c(C)c1.
What is the InChIKey of N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine?
The InChIKey is FEOVIARSGJGVNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3/c1-5-19-11-16-10-15(4)18(20-12-16)21(13-14(2)3)17-8-6-7-9-17/h10,12,14,17,19H,5-9,11,13H2,1-4H3.
What are the key properties of N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine?
N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine has a molecular weight of 289.47 g/mol, XLogP of 3.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(ethylaminomethyl)-3-methyl-N-(2-methylpropyl)pyridin-2-amine is sourced from PubChem (CID 80638803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).