3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine

C17H30N4 — CID 79061268

IUPAC3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine
SMILESCCNC(Cc1cnccc1N)C1(N(C)C)CCCCC1
InChIInChI=1S/C17H30N4/c1-4-20-16(12-14-13-19-11-8-15(14)18)17(21(2)3)9-6-5-7-10-17/h8,11,13,16,20H,4-7,9-10,12H2,1-3H3,(H2,18,19)
InChIKeyKINFUBMSOLUHJY-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.45
Rot. Bonds6

About 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine

3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine (PubChem CID 79061268) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine
PubChem CID79061268
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine
SMILESCCNC(Cc1cnccc1N)C1(N(C)C)CCCCC1
InChIInChI=1S/C17H30N4/c1-4-20-16(12-14-13-19-11-8-15(14)18)17(21(2)3)9-6-5-7-10-17/h8,11,13,16,20H,4-7,9-10,12H2,1-3H3,(H2,18,19)
InChIKeyKINFUBMSOLUHJY-UHFFFAOYSA-N
XLogP2.45
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-[1-(dimethylamino)cyclohexyl]-2-(methylamino)ethyl]pyridin-4-amine
CID 79066965
1-[1-(ethylamino)-2-phenylethyl]-N,N-dimethylcycloheptan-1-amine
CID 79063752
3-[2-(1-methoxycyclohexyl)-2-(methylamino)ethyl]pyridin-4-amine
CID 116763051
1-[2-(3-chloro-4-pyridinyl)-1-hydrazinylethyl]-N,N-dimethylcycloheptan-1-amine
CID 105243834
1-[2-(3-chloro-4-pyridinyl)-1-(methylamino)ethyl]-N,N-dimethylcycloheptan-1-amine
CID 79064182
3-[2-amino-2-(1-ethoxycyclohexyl)ethyl]pyridin-4-amine
CID 116763733
4-(4-amino-3-pyridinyl)-3-N-ethyl-1-N,1-N-dimethylbutane-1,3-diamine
CID 113291301
1-[1-(ethylamino)-2-pyridin-2-ylethyl]-N,N-dimethylcyclopentan-1-amine
CID 79070225
3-[[1-(dimethylamino)cyclohexyl]-(methylamino)methyl]pyridin-4-amine
CID 79066743
1-[ethylamino-(3-fluoro-4-pyridinyl)methyl]-N,N-dimethylcycloheptan-1-amine
CID 104738479
1-[1-(ethylamino)-2-(5-ethyl-2-pyridinyl)ethyl]-N,N-dimethylcyclopentan-1-amine
CID 79740571
1-[2-(5-chlorothiophen-2-yl)-1-(ethylamino)ethyl]-N,N-dimethylcyclopentan-1-amine
CID 79070614

Frequently Asked Questions

What is the IUPAC name of 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine?
The IUPAC name of 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine (CID 79061268) is 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine.
What is the SMILES notation for 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine?
The canonical SMILES for 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine is CCNC(Cc1cnccc1N)C1(N(C)C)CCCCC1.
What is the InChIKey of 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine?
The InChIKey is KINFUBMSOLUHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-4-20-16(12-14-13-19-11-8-15(14)18)17(21(2)3)9-6-5-7-10-17/h8,11,13,16,20H,4-7,9-10,12H2,1-3H3,(H2,18,19).
What are the key properties of 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine?
3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine has a molecular weight of 290.45 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[1-(dimethylamino)cyclohexyl]-2-(ethylamino)ethyl]pyridin-4-amine is sourced from PubChem (CID 79061268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).