3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine

C14H23N3O — CID 104611312

IUPAC3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine
SMILESCCNC(c1cnccc1N)C1(OC)CCCC1
InChIInChI=1S/C14H23N3O/c1-3-17-13(11-10-16-9-6-12(11)15)14(18-2)7-4-5-8-14/h6,9-10,13,17H,3-5,7-8H2,1-2H3,(H2,15,16)
InChIKeyMIYSHSCIINGCRQ-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.27
Rot. Bonds5

About 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine

3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine (PubChem CID 104611312) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine
PubChem CID104611312
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine
SMILESCCNC(c1cnccc1N)C1(OC)CCCC1
InChIInChI=1S/C14H23N3O/c1-3-17-13(11-10-16-9-6-12(11)15)14(18-2)7-4-5-8-14/h6,9-10,13,17H,3-5,7-8H2,1-2H3,(H2,15,16)
InChIKeyMIYSHSCIINGCRQ-UHFFFAOYSA-N
XLogP2.27
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(1-methoxycyclohexyl)-(propylamino)methyl]pyridin-4-amine
CID 116763449
3-[(1-ethoxycyclohexyl)-(ethylamino)methyl]pyridin-4-amine
CID 116764129
(4-amino-3-pyridinyl)-(1-methoxycycloheptyl)methanol
CID 116756029
3-[amino-(1-methoxycycloheptyl)methyl]pyridin-4-amine
CID 116769953
3-[amino-(1-methoxycyclobutyl)methyl]pyridin-4-amine
CID 116714089
N-[isoquinolin-4-yl-(1-methoxycyclopentyl)methyl]ethanamine
CID 104611200
(4-amino-3-pyridinyl)-(1-ethoxycycloheptyl)methanol
CID 116756255
N-[(1-methoxycyclohexyl)-(2,3,4-trifluorophenyl)methyl]ethanamine
CID 116763285
N-[(1-methoxycyclopentyl)-(5-methyl-3-pyridinyl)methyl]ethanamine
CID 113432853
3-[2-(1-methoxycyclohexyl)-2-(methylamino)ethyl]pyridin-4-amine
CID 116763051
N-[(1-methoxycyclopentyl)-(4-methylphenyl)methyl]ethanamine
CID 104611192
3-[[1-(dimethylamino)cyclohexyl]-(methylamino)methyl]pyridin-4-amine
CID 79066743

Frequently Asked Questions

What is the IUPAC name of 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine?
The IUPAC name of 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine (CID 104611312) is 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine.
What is the SMILES notation for 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine?
The canonical SMILES for 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine is CCNC(c1cnccc1N)C1(OC)CCCC1.
What is the InChIKey of 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine?
The InChIKey is MIYSHSCIINGCRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-17-13(11-10-16-9-6-12(11)15)14(18-2)7-4-5-8-14/h6,9-10,13,17H,3-5,7-8H2,1-2H3,(H2,15,16).
What are the key properties of 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine?
3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethylamino-(1-methoxycyclopentyl)methyl]pyridin-4-amine is sourced from PubChem (CID 104611312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).