N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide

C14H20N4O2 — CID 102736180

IUPACN-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)c2ncccc2N)CC1
InChIInChI=1S/C14H20N4O2/c1-10(19)17-9-11-4-7-18(8-5-11)14(20)13-12(15)3-2-6-16-13/h2-3,6,11H,4-5,7-9,15H2,1H3,(H,17,19)
InChIKeyORGVOKJQLKJVTG-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.65
Rot. Bonds3

About N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide

N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide (PubChem CID 102736180) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide
PubChem CID102736180
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)c2ncccc2N)CC1
InChIInChI=1S/C14H20N4O2/c1-10(19)17-9-11-4-7-18(8-5-11)14(20)13-12(15)3-2-6-16-13/h2-3,6,11H,4-5,7-9,15H2,1H3,(H,17,19)
InChIKeyORGVOKJQLKJVTG-UHFFFAOYSA-N
XLogP0.65
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]acetamide
CID 104741733
3-amino-N-(cyclopropylmethyl)pyridine-2-carboxamide
CID 104740792
(3-amino-2-pyridinyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 104742169
N-[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]ethanesulfonamide
CID 104741726
N-[[1-(4-amino-1-ethylpyrazole-3-carbonyl)piperidin-4-yl]methyl]acetamide
CID 102735847
[4-(ethylaminomethyl)piperidin-1-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 80552354
(3-amino-2-pyridinyl)-[4-(trifluoromethyl)piperidin-1-yl]methanone
CID 104742473
N-[[1-(4-amino-3-hydroxybenzoyl)piperidin-4-yl]methyl]acetamide
CID 102739429
(3-amino-2-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 104742285
N-[[1-(2-amino-5-bromobenzoyl)piperidin-4-yl]methyl]acetamide
CID 102736730
N-[[1-(2-bromopyridine-4-carbonyl)piperidin-4-yl]methyl]acetamide
CID 103754890
(3-amino-2-pyridinyl)-(4-phenylpiperidin-1-yl)methanone;propan-1-ol
CID 143724925

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide (CID 102736180) is N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(C(=O)c2ncccc2N)CC1.
What is the InChIKey of N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
The InChIKey is ORGVOKJQLKJVTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-10(19)17-9-11-4-7-18(8-5-11)14(20)13-12(15)3-2-6-16-13/h2-3,6,11H,4-5,7-9,15H2,1H3,(H,17,19).
What are the key properties of N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide has a molecular weight of 276.34 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 102736180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).