N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide

C15H30N4O — CID 65070563

IUPACN-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(NC2CCCN(C)CC2)CC1
InChIInChI=1S/C15H30N4O/c1-16-15(20)12-19-10-6-14(7-11-19)17-13-4-3-8-18(2)9-5-13/h13-14,17H,3-12H2,1-2H3,(H,16,20)
InChIKeyUKQLHVYYKYBAER-UHFFFAOYSA-N
MW282.43 g/mol
LogP0.27
Rot. Bonds4

About N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide

N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide (PubChem CID 65070563) has the molecular formula C15H30N4O and a molecular weight of 282.43 g/mol. Its IUPAC name is N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide
PubChem CID65070563
Molecular FormulaC15H30N4O
Molecular Weight282.43 g/mol
Exact Mass282.24
IUPAC NameN-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(NC2CCCN(C)CC2)CC1
InChIInChI=1S/C15H30N4O/c1-16-15(20)12-19-10-6-14(7-11-19)17-13-4-3-8-18(2)9-5-13/h13-14,17H,3-12H2,1-2H3,(H,16,20)
InChIKeyUKQLHVYYKYBAER-UHFFFAOYSA-N
XLogP0.27
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide
CID 43435274
2-[4-[(3-aminocyclohexyl)amino]piperidin-1-yl]-N-methylacetamide
CID 79458461
2-[4-[(3-cyclopropylcyclohexyl)amino]piperidin-1-yl]-N-methylacetamide
CID 64595857
N-methyl-2-[4-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]piperidin-1-yl]acetamide
CID 43691453
2-[4-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylamino)piperidin-1-yl]-N-methylacetamide
CID 82853286
N-methyl-2-[4-[(1-prop-2-ynylpiperidin-4-yl)amino]piperidin-1-yl]acetamide
CID 43782791
N-methyl-2-(4-methyl-1,4-diazepan-1-yl)acetamide
CID 89043934
ethane;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide
CID 142367954
N-cyclopropyl-1-methylazepan-4-amine
CID 65071330
N-methyl-2-[(3S)-3-(methylamino)pyrrolidin-1-yl]acetamide
CID 170394930
N-methyl-2-[4-[(2-methyloxolan-3-yl)amino]piperidin-1-yl]acetamide
CID 115335740
2-amino-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]acetamide
CID 43704790

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide?
The IUPAC name of N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide (CID 65070563) is N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide is CNC(=O)CN1CCC(NC2CCCN(C)CC2)CC1.
What is the InChIKey of N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide?
The InChIKey is UKQLHVYYKYBAER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O/c1-16-15(20)12-19-10-6-14(7-11-19)17-13-4-3-8-18(2)9-5-13/h13-14,17H,3-12H2,1-2H3,(H,16,20).
What are the key properties of N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide?
N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide has a molecular weight of 282.43 g/mol, XLogP of 0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-[(1-methylazepan-4-yl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 65070563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).