2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide

C14H22N4O — CID 102877705

IUPAC2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide
SMILESCc1cncc(CN(CC(N)=O)C2CCNCC2)c1
InChIInChI=1S/C14H22N4O/c1-11-6-12(8-17-7-11)9-18(10-14(15)19)13-2-4-16-5-3-13/h6-8,13,16H,2-5,9-10H2,1H3,(H2,15,19)
InChIKeyROBBTBNTDCHYJM-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.43
Rot. Bonds5

About 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide

2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide (PubChem CID 102877705) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide.

Molecular Properties

Compound Name2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide
PubChem CID102877705
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide
SMILESCc1cncc(CN(CC(N)=O)C2CCNCC2)c1
InChIInChI=1S/C14H22N4O/c1-11-6-12(8-17-7-11)9-18(10-14(15)19)13-2-4-16-5-3-13/h6-8,13,16H,2-5,9-10H2,1H3,(H2,15,19)
InChIKeyROBBTBNTDCHYJM-UHFFFAOYSA-N
XLogP0.43
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[piperidin-4-yl(1,3-thiazol-5-ylmethyl)amino]acetamide
CID 112641538
2-[(5-bromo-3-pyridinyl)methyl-cyclopentylamino]acetamide
CID 113224901
2-[(3-chloro-4-fluorophenyl)methyl-piperidin-4-ylamino]acetamide
CID 103038748
2-[(3-methyl-2-pyridinyl)methyl-piperidin-4-ylamino]acetamide
CID 112650951
N'-cyclopropyl-N'-[(5-methyl-3-pyridinyl)methyl]propane-1,3-diamine
CID 102880556
N-(2-bromoethyl)-N-[(5-methyl-3-pyridinyl)methyl]cyclopropanamine
CID 102878934
N'-cyclohexyl-N'-[(5-methyl-3-pyridinyl)methyl]ethane-1,2-diamine
CID 102879102
N-(2-chloroethyl)-N-[(5-methyl-3-pyridinyl)methyl]cyclopentanamine
CID 102878812
2-[2-(3-methylphenoxy)ethyl-piperidin-4-ylamino]acetamide
CID 60802291
2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide
CID 56812522
2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide
CID 61497293
2-[[2-[cyclopropyl(methyl)amino]-2-oxoethyl]-piperidin-4-ylamino]acetamide
CID 61489246

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide?
The IUPAC name of 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide (CID 102877705) is 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide.
What is the SMILES notation for 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide?
The canonical SMILES for 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide is Cc1cncc(CN(CC(N)=O)C2CCNCC2)c1.
What is the InChIKey of 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide?
The InChIKey is ROBBTBNTDCHYJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-11-6-12(8-17-7-11)9-18(10-14(15)19)13-2-4-16-5-3-13/h6-8,13,16H,2-5,9-10H2,1H3,(H2,15,19).
What are the key properties of 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide?
2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide has a molecular weight of 262.36 g/mol, XLogP of 0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide is sourced from PubChem (CID 102877705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).