2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide

C16H26N4O — CID 125442607

IUPAC2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide
SMILESCc1cccnc1[C@H](C)NC(=O)CN(C)C1CCNCC1
InChIInChI=1S/C16H26N4O/c1-12-5-4-8-18-16(12)13(2)19-15(21)11-20(3)14-6-9-17-10-7-14/h4-5,8,13-14,17H,6-7,9-11H2,1-3H3,(H,19,21)/t13-/m0/s1
InChIKeyHNHHGXMDIWNSLO-ZDUSSCGKSA-N
MW290.41 g/mol
LogP1.25
Rot. Bonds5

About 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide

2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide (PubChem CID 125442607) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide
PubChem CID125442607
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide
SMILESCc1cccnc1[C@H](C)NC(=O)CN(C)C1CCNCC1
InChIInChI=1S/C16H26N4O/c1-12-5-4-8-18-16(12)13(2)19-15(21)11-20(3)14-6-9-17-10-7-14/h4-5,8,13-14,17H,6-7,9-11H2,1-3H3,(H,19,21)/t13-/m0/s1
InChIKeyHNHHGXMDIWNSLO-ZDUSSCGKSA-N
XLogP1.25
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Amrinone
CID 3698
2-[3-(2,2-Difluoro-2-pyridin-2-yl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-N-(3-fluoro-4-methyl-pyridin-2-ylmethyl)-acetamide
CID 447221
Tagorizine
CID 6436051
UR-12460
CID 9889404
Lsn2463359
CID 72551298
Kdoam-25
CID 91810435
N,N'-bis[(pyridin-2-yl)methyl]ethanediamide
CID 3113972
Amd-8664
CID 483559
2-(4-Benzyl-1-piperazinyl)-N'-(1-(4-pyridinyl)ethylidene)acetohydrazide
CID 9617944
(3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(pyridin-2-ylmethyl)-1,4-diazepan-2-one
CID 23646451
2-(6-Chloro-3-((2,2-difluoro-2-(2-pyridinyl)ethyl)amino)-2-oxo-1(2H)-pyrazinyl)-N-((2-fluoro-6-pyridinyl)methyl)acetamide
CID 447219
1-(3-(N-(Methoxycarbonyl)amino)-3-phenylpropanoyl)-4-((2-methyl-3-pyridyl)cyanomethyl)piperazine
CID 3025824

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide?
The IUPAC name of 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide (CID 125442607) is 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide.
What is the SMILES notation for 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide?
The canonical SMILES for 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide is Cc1cccnc1[C@H](C)NC(=O)CN(C)C1CCNCC1.
What is the InChIKey of 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide?
The InChIKey is HNHHGXMDIWNSLO-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12-5-4-8-18-16(12)13(2)19-15(21)11-20(3)14-6-9-17-10-7-14/h4-5,8,13-14,17H,6-7,9-11H2,1-3H3,(H,19,21)/t13-/m0/s1.
What are the key properties of 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide?
2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide has a molecular weight of 290.41 g/mol, XLogP of 1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide is sourced from PubChem (CID 125442607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).