3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide

C14H22N4O — CID 39181563

IUPAC3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide
SMILESCC1CCN(c2ccc(NC(=O)CCN)cn2)CC1
InChIInChI=1S/C14H22N4O/c1-11-5-8-18(9-6-11)13-3-2-12(10-16-13)17-14(19)4-7-15/h2-3,10-11H,4-9,15H2,1H3,(H,17,19)
InChIKeyDCUKAABKBMLCJN-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.61
Rot. Bonds4

About 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide

3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide (PubChem CID 39181563) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide
PubChem CID39181563
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide
SMILESCC1CCN(c2ccc(NC(=O)CCN)cn2)CC1
InChIInChI=1S/C14H22N4O/c1-11-5-8-18(9-6-11)13-3-2-12(10-16-13)17-14(19)4-7-15/h2-3,10-11H,4-9,15H2,1H3,(H,17,19)
InChIKeyDCUKAABKBMLCJN-UHFFFAOYSA-N
XLogP1.61
TPSA71.25 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 ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide?
The IUPAC name of 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide (CID 39181563) is 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide.
What is the SMILES notation for 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide?
The canonical SMILES for 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide is CC1CCN(c2ccc(NC(=O)CCN)cn2)CC1.
What is the InChIKey of 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide?
The InChIKey is DCUKAABKBMLCJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-11-5-8-18(9-6-11)13-3-2-12(10-16-13)17-14(19)4-7-15/h2-3,10-11H,4-9,15H2,1H3,(H,17,19).
What are the key properties of 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide?
3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide has a molecular weight of 262.36 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]propanamide is sourced from PubChem (CID 39181563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).