1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide

C14H22N4O — CID 112584021

IUPAC1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide
SMILESCCC(N)c1ccc(N2CCCC(C(N)=O)C2)cn1
InChIInChI=1S/C14H22N4O/c1-2-12(15)13-6-5-11(8-17-13)18-7-3-4-10(9-18)14(16)19/h5-6,8,10,12H,2-4,7,9,15H2,1H3,(H2,16,19)
InChIKeyZXZQOKKFZZHUFT-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.19
Rot. Bonds4

About 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide

1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide (PubChem CID 112584021) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide
PubChem CID112584021
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide
SMILESCCC(N)c1ccc(N2CCCC(C(N)=O)C2)cn1
InChIInChI=1S/C14H22N4O/c1-2-12(15)13-6-5-11(8-17-13)18-7-3-4-10(9-18)14(16)19/h5-6,8,10,12H,2-4,7,9,15H2,1H3,(H2,16,19)
InChIKeyZXZQOKKFZZHUFT-UHFFFAOYSA-N
XLogP1.19
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-3-yl]methanol
CID 103937018
1-[6-(1-aminopropyl)-3-pyridinyl]-N,N-dimethylpiperidin-3-amine
CID 112584494
(1R)-1-[5-[3-(trifluoromethyl)piperidin-1-yl]-2-pyridinyl]propan-1-amine
CID 103937448
1-[6-[(1R)-1-hydroxypropyl]-3-pyridinyl]-N-methylpiperidine-3-carboxamide
CID 103196779
1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-4-ol
CID 103936925
1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 112584254
1-[1-[6-(1-aminopropyl)-3-pyridinyl]piperidin-4-yl]ethanol
CID 106836278
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
CID 103936871
(1S)-1-[5-(3,4-dimethylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355142
N-[[1-[6-[(1S)-1-aminopropyl]-3-pyridinyl]piperidin-4-yl]methyl]acetamide
CID 102736474
1-[6-[(1R)-1-aminoethyl]-3-pyridinyl]piperidine-4-carboxamide
CID 83122876
1-[5-(1-oxo-1,4-thiazinan-4-yl)-2-pyridinyl]propan-1-amine
CID 112584315

Frequently Asked Questions

What is the IUPAC name of 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide?
The IUPAC name of 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide (CID 112584021) is 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide?
The canonical SMILES for 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide is CCC(N)c1ccc(N2CCCC(C(N)=O)C2)cn1.
What is the InChIKey of 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide?
The InChIKey is ZXZQOKKFZZHUFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-2-12(15)13-6-5-11(8-17-13)18-7-3-4-10(9-18)14(16)19/h5-6,8,10,12H,2-4,7,9,15H2,1H3,(H2,16,19).
What are the key properties of 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide?
1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(1-aminopropyl)-3-pyridinyl]piperidine-3-carboxamide is sourced from PubChem (CID 112584021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).