(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine

C14H23N3 — CID 103936871

IUPAC(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
SMILESCC[C@H](N)c1ccc(N2CCC(C)CC2)cn1
InChIInChI=1S/C14H23N3/c1-3-13(15)14-5-4-12(10-16-14)17-8-6-11(2)7-9-17/h4-5,10-11,13H,3,6-9,15H2,1-2H3/t13-/m0/s1
InChIKeyCEGIJAKTARSTBI-ZDUSSCGKSA-N
MW233.36 g/mol
LogP2.73
Rot. Bonds3

About (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine

(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine (PubChem CID 103936871) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
PubChem CID103936871
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
SMILESCC[C@H](N)c1ccc(N2CCC(C)CC2)cn1
InChIInChI=1S/C14H23N3/c1-3-13(15)14-5-4-12(10-16-14)17-8-6-11(2)7-9-17/h4-5,10-11,13H,3,6-9,15H2,1-2H3/t13-/m0/s1
InChIKeyCEGIJAKTARSTBI-ZDUSSCGKSA-N
XLogP2.73
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 112584254
1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-4-ol
CID 103936925
1-[1-[6-(1-aminopropyl)-3-pyridinyl]piperidin-4-yl]ethanol
CID 106836278
1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 112585215
(1S)-1-[5-(3,4-dimethylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355142
(1R)-1-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355072
(1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine
CID 103937123
N-[[1-[6-[(1S)-1-aminopropyl]-3-pyridinyl]piperidin-4-yl]methyl]acetamide
CID 102736474
1-[5-(1-oxo-1,4-thiazinan-4-yl)-2-pyridinyl]propan-1-amine
CID 112584315
(1S)-1-[5-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]propan-1-amine
CID 103937012
(1S)-1-[5-(4-methylazepan-1-yl)-2-pyridinyl]ethanamine
CID 83127542
N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine
CID 83131415

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine?
The IUPAC name of (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine (CID 103936871) is (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine?
The canonical SMILES for (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine is CC[C@H](N)c1ccc(N2CCC(C)CC2)cn1.
What is the InChIKey of (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine?
The InChIKey is CEGIJAKTARSTBI-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-13(15)14-5-4-12(10-16-14)17-8-6-11(2)7-9-17/h4-5,10-11,13H,3,6-9,15H2,1-2H3/t13-/m0/s1.
What are the key properties of (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine?
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine has a molecular weight of 233.36 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 103936871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).