N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide

C14H28N4O2 — CID 63644254

IUPACN-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide
SMILESCC(C)CCNC(=O)NC(=O)CN(C)C1CCCNC1
InChIInChI=1S/C14H28N4O2/c1-11(2)6-8-16-14(20)17-13(19)10-18(3)12-5-4-7-15-9-12/h11-12,15H,4-10H2,1-3H3,(H2,16,17,19,20)
InChIKeyPQKXVRBZTMDPDC-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.54
Rot. Bonds6

About N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide

N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide (PubChem CID 63644254) has the molecular formula C14H28N4O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide
PubChem CID63644254
Molecular FormulaC14H28N4O2
Molecular Weight284.40 g/mol
Exact Mass284.22
IUPAC NameN-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide
SMILESCC(C)CCNC(=O)NC(=O)CN(C)C1CCCNC1
InChIInChI=1S/C14H28N4O2/c1-11(2)6-8-16-14(20)17-13(19)10-18(3)12-5-4-7-15-9-12/h11-12,15H,4-10H2,1-3H3,(H2,16,17,19,20)
InChIKeyPQKXVRBZTMDPDC-UHFFFAOYSA-N
XLogP0.54
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylbutyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 55248733
N-(butylcarbamoyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide
CID 63301724
N-cyclohexyl-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63644075
2-[cyclohexyl(methyl)amino]-N-(propylcarbamoyl)acetamide
CID 40706145
2-[azepan-4-yl(methyl)amino]-N-(methylcarbamoyl)acetamide
CID 104979461
2-[azetidin-3-yl(methyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide
CID 66185736
N-methyl-N-(2-methylpropyl)piperidin-3-amine
CID 43317078
4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide
CID 63644286
2-[azepan-4-yl(methyl)amino]-N-(cyclopropylcarbamoyl)acetamide
CID 104979591
N-(4-methylcyclohexyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 55249118
2-[cycloheptyl(methyl)amino]-N-(ethylcarbamoyl)acetamide
CID 16577824
2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide
CID 46800805

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide?
The IUPAC name of N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide (CID 63644254) is N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide.
What is the SMILES notation for N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide?
The canonical SMILES for N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide is CC(C)CCNC(=O)NC(=O)CN(C)C1CCCNC1.
What is the InChIKey of N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide?
The InChIKey is PQKXVRBZTMDPDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O2/c1-11(2)6-8-16-14(20)17-13(19)10-18(3)12-5-4-7-15-9-12/h11-12,15H,4-10H2,1-3H3,(H2,16,17,19,20).
What are the key properties of N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide?
N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide has a molecular weight of 284.40 g/mol, XLogP of 0.54, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide is sourced from PubChem (CID 63644254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).