3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine

C16H27N3 — CID 65409654

IUPAC3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine
SMILESCCNC(Cc1cnccc1N)C1CCC(CC)C1
InChIInChI=1S/C16H27N3/c1-3-12-5-6-13(9-12)16(19-4-2)10-14-11-18-8-7-15(14)17/h7-8,11-13,16,19H,3-6,9-10H2,1-2H3,(H2,17,18)
InChIKeyNNFRRJWDADLPPT-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.01
Rot. Bonds6

About 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine

3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine (PubChem CID 65409654) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine
PubChem CID65409654
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine
SMILESCCNC(Cc1cnccc1N)C1CCC(CC)C1
InChIInChI=1S/C16H27N3/c1-3-12-5-6-13(9-12)16(19-4-2)10-14-11-18-8-7-15(14)17/h7-8,11-13,16,19H,3-6,9-10H2,1-2H3,(H2,17,18)
InChIKeyNNFRRJWDADLPPT-UHFFFAOYSA-N
XLogP3.01
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine?
The IUPAC name of 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine (CID 65409654) is 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine.
What is the SMILES notation for 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine?
The canonical SMILES for 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine is CCNC(Cc1cnccc1N)C1CCC(CC)C1.
What is the InChIKey of 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine?
The InChIKey is NNFRRJWDADLPPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-3-12-5-6-13(9-12)16(19-4-2)10-14-11-18-8-7-15(14)17/h7-8,11-13,16,19H,3-6,9-10H2,1-2H3,(H2,17,18).
What are the key properties of 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine?
3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine has a molecular weight of 261.41 g/mol, XLogP of 3.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine is sourced from PubChem (CID 65409654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).