6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine

C14H23N3 — CID 83122501

IUPAC6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine
SMILESCCCCN(c1ccc(C(C)N)nc1)C1CC1
InChIInChI=1S/C14H23N3/c1-3-4-9-17(12-5-6-12)13-7-8-14(11(2)15)16-10-13/h7-8,10-12H,3-6,9,15H2,1-2H3
InChIKeyRPHSKPXHQJKFBB-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.87
Rot. Bonds6

About 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine

6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine (PubChem CID 83122501) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine.

Molecular Properties

Compound Name6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine
PubChem CID83122501
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine
SMILESCCCCN(c1ccc(C(C)N)nc1)C1CC1
InChIInChI=1S/C14H23N3/c1-3-4-9-17(12-5-6-12)13-7-8-14(11(2)15)16-10-13/h7-8,10-12H,3-6,9,15H2,1-2H3
InChIKeyRPHSKPXHQJKFBB-UHFFFAOYSA-N
XLogP2.87
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(1S)-1-aminoethyl]-N-cyclopropyl-N-(2-methoxyethyl)pyridin-3-amine
CID 83122840
N-butyl-N-cyclopropyl-6-[1-(ethylamino)propyl]pyridin-3-amine
CID 115939376
6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine
CID 83122472
6-[(1S)-1-aminoethyl]-N-methyl-N-(4-methylcyclohexyl)pyridin-3-amine
CID 83123084
N-cyclopropyl-6-[1-(ethylamino)ethyl]-N-propylpyridin-3-amine
CID 83122891
6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine
CID 103936962
6-[(1S)-1-aminoethyl]-N-(cyclopropylmethyl)-N-propylpyridin-3-amine
CID 83122583
2-[cyclopropyl-[6-[1-(propylamino)ethyl]-3-pyridinyl]amino]ethanol
CID 83122512
(1S)-1-[5-[cyclopropyl(2-hydroxyethyl)amino]-2-pyridinyl]propan-1-ol
CID 103938569
6-[(1R)-1-aminopropyl]-N-cyclopropyl-N-(cyclopropylmethyl)pyridin-3-amine
CID 103937427
N-cyclopropyl-N-propyl-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939237
N-cyclopropyl-N-(2-methoxyethyl)-6-[1-(propylamino)ethyl]pyridin-3-amine
CID 83123007

Frequently Asked Questions

What is the IUPAC name of 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine?
The IUPAC name of 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine (CID 83122501) is 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine.
What is the SMILES notation for 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine?
The canonical SMILES for 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine is CCCCN(c1ccc(C(C)N)nc1)C1CC1.
What is the InChIKey of 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine?
The InChIKey is RPHSKPXHQJKFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-4-9-17(12-5-6-12)13-7-8-14(11(2)15)16-10-13/h7-8,10-12H,3-6,9,15H2,1-2H3.
What are the key properties of 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine?
6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine has a molecular weight of 233.36 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine is sourced from PubChem (CID 83122501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).