N-[(1-methylcycloheptyl)methyl]acetamide

C11H21NO — CID 127751208

IUPACN-[(1-methylcycloheptyl)methyl]acetamide
SMILESCC(=O)NCC1(C)CCCCCC1
InChIInChI=1S/C11H21NO/c1-10(13)12-9-11(2)7-5-3-4-6-8-11/h3-9H2,1-2H3,(H,12,13)
InChIKeyZZBALULSKMWGAD-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.48
Rot. Bonds2

About N-[(1-methylcycloheptyl)methyl]acetamide

N-[(1-methylcycloheptyl)methyl]acetamide (PubChem CID 127751208) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-[(1-methylcycloheptyl)methyl]acetamide.

Molecular Properties

Compound NameN-[(1-methylcycloheptyl)methyl]acetamide
PubChem CID127751208
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-[(1-methylcycloheptyl)methyl]acetamide
SMILESCC(=O)NCC1(C)CCCCCC1
InChIInChI=1S/C11H21NO/c1-10(13)12-9-11(2)7-5-3-4-6-8-11/h3-9H2,1-2H3,(H,12,13)
InChIKeyZZBALULSKMWGAD-UHFFFAOYSA-N
XLogP2.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1,3-dimethylazetidin-3-yl)methyl]acetamide
CID 167168227
(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798136
(E)-N-[(1-methylcyclohexyl)methyl]but-2-enamide
CID 103753261
2,3-dimethyl-4-[(1-methylcyclopentyl)methylamino]-4-oxobut-2-enoic acid
CID 77020299
2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798125
2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide
CID 103515473
1-methyl-N-[(1-methylcyclobutyl)methyl]cyclopropane-1-carboxamide
CID 126990723
1-methyl-3-[(1-methylcyclobutyl)methyl]urea
CID 103735098
N-[[1-(aminomethyl)cyclopentyl]methyl]acetamide
CID 115365421
3-amino-2-methyl-N-[(1-methylcyclohexyl)methyl]butanamide
CID 103581061
ethane;formaldehyde;N-[(1-methylcyclohexyl)methyl]cyclohexanecarboxamide
CID 90789963
1,1-diethyl-3-[(1-methylcyclopentyl)methyl]urea
CID 115618855

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcycloheptyl)methyl]acetamide?
The IUPAC name of N-[(1-methylcycloheptyl)methyl]acetamide (CID 127751208) is N-[(1-methylcycloheptyl)methyl]acetamide.
What is the SMILES notation for N-[(1-methylcycloheptyl)methyl]acetamide?
The canonical SMILES for N-[(1-methylcycloheptyl)methyl]acetamide is CC(=O)NCC1(C)CCCCCC1.
What is the InChIKey of N-[(1-methylcycloheptyl)methyl]acetamide?
The InChIKey is ZZBALULSKMWGAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(13)12-9-11(2)7-5-3-4-6-8-11/h3-9H2,1-2H3,(H,12,13).
What are the key properties of N-[(1-methylcycloheptyl)methyl]acetamide?
N-[(1-methylcycloheptyl)methyl]acetamide has a molecular weight of 183.29 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcycloheptyl)methyl]acetamide is sourced from PubChem (CID 127751208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).