6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine

C13H21N3 — CID 103936962

IUPAC6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(CC)C2CC2)cn1
InChIInChI=1S/C13H21N3/c1-3-12(14)13-8-7-11(9-15-13)16(4-2)10-5-6-10/h7-10,12H,3-6,14H2,1-2H3/t12-/m0/s1
InChIKeyQILXGJGSXOACRS-LBPRGKRZSA-N
MW219.33 g/mol
LogP2.48
Rot. Bonds5

About 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine

6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine (PubChem CID 103936962) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine.

Molecular Properties

Compound Name6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine
PubChem CID103936962
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(CC)C2CC2)cn1
InChIInChI=1S/C13H21N3/c1-3-12(14)13-8-7-11(9-15-13)16(4-2)10-5-6-10/h7-10,12H,3-6,14H2,1-2H3/t12-/m0/s1
InChIKeyQILXGJGSXOACRS-LBPRGKRZSA-N
XLogP2.48
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(1-aminopropyl)-N-cyclopentyl-N-ethylpyridin-3-amine
CID 112584188
6-[(1R)-1-aminopropyl]-N-cyclopropyl-N-(cyclopropylmethyl)pyridin-3-amine
CID 103937427
6-[(1R)-1-aminopropyl]-N-methyl-N-(4-methylcyclohexyl)pyridin-3-amine
CID 103937109
6-(1-aminopropyl)-N-cyclopropyl-N-(furan-2-ylmethyl)pyridin-3-amine
CID 115939467
1-[5-[cyclopentyl(ethyl)amino]-2-pyridinyl]propan-1-ol
CID 112585280
6-(1-aminopropyl)-N,N-diethylpyridin-3-amine
CID 112584036
6-[(1R)-1-aminopropyl]-N-(cyclopropylmethyl)-N-methylpyridin-3-amine
CID 103937043
6-[(1R)-1-aminopropyl]-N-methyl-N-(3-methylcyclohexyl)pyridin-3-amine
CID 103937129
6-(1-aminoethyl)-N-butyl-N-cyclopropylpyridin-3-amine
CID 83122501
6-(1-aminopropyl)-N-ethyl-N-phenylpyridin-3-amine
CID 112584084
(1S)-1-[5-[cyclopropyl(2-hydroxyethyl)amino]-2-pyridinyl]propan-1-ol
CID 103938569
(1R)-1-[5-[cyclopropyl(2-methylpropyl)amino]-2-pyridinyl]propan-1-ol
CID 113355348

Frequently Asked Questions

What is the IUPAC name of 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine?
The IUPAC name of 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine (CID 103936962) is 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine.
What is the SMILES notation for 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine?
The canonical SMILES for 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine is CC[C@H](N)c1ccc(N(CC)C2CC2)cn1.
What is the InChIKey of 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine?
The InChIKey is QILXGJGSXOACRS-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H21N3/c1-3-12(14)13-8-7-11(9-15-13)16(4-2)10-5-6-10/h7-10,12H,3-6,14H2,1-2H3/t12-/m0/s1.
What are the key properties of 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine?
6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1S)-1-aminopropyl]-N-cyclopropyl-N-ethylpyridin-3-amine is sourced from PubChem (CID 103936962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).