N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide

C16H32N2O — CID 65080591

IUPACN,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide
SMILESCC(C)CC(NC1CCCC(C)CC1)C(=O)N(C)C
InChIInChI=1S/C16H32N2O/c1-12(2)11-15(16(19)18(4)5)17-14-8-6-7-13(3)9-10-14/h12-15,17H,6-11H2,1-5H3
InChIKeyIELVCIMVEJMIIB-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.05
Rot. Bonds5

About N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide

N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide (PubChem CID 65080591) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide.

Molecular Properties

Compound NameN,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide
PubChem CID65080591
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide
SMILESCC(C)CC(NC1CCCC(C)CC1)C(=O)N(C)C
InChIInChI=1S/C16H32N2O/c1-12(2)11-15(16(19)18(4)5)17-14-8-6-7-13(3)9-10-14/h12-15,17H,6-11H2,1-5H3
InChIKeyIELVCIMVEJMIIB-UHFFFAOYSA-N
XLogP3.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-aminocyclohexyl)amino]-N,N,4-trimethylpentanamide
CID 79723960
N,N,4-trimethyl-2-[(1-propylpiperidin-4-yl)amino]pentanamide
CID 43674980
(2R)-N,N-dimethyl-2-[(4-methylcyclohexyl)amino]propanamide
CID 92666114
2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide
CID 81334194
4-methyl-2-[(4-methylcycloheptyl)amino]pentan-1-ol
CID 65079779
2-[(2-methoxycyclohexyl)amino]-N,N,4-trimethylpentanamide
CID 43779376
2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide
CID 112554585
4-methyl-2-[(3-methylcyclopentyl)amino]pentanoic acid
CID 64501348
methyl 4-methyl-2-[(4-propan-2-ylcycloheptyl)amino]pentanoate
CID 65086959
2-(cyclohexylmethylamino)-N,N,4-trimethylpentanamide
CID 43674999
1-amino-N-[1-(dimethylamino)-4-methyl-1-oxopentan-2-yl]-3-methylcyclohexane-1-carboxamide
CID 64551440
2-[[cyclohexyl(methyl)sulfamoyl]amino]-N,N,4-trimethylpentanamide
CID 47034956

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide?
The IUPAC name of N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide (CID 65080591) is N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide.
What is the SMILES notation for N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide?
The canonical SMILES for N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide is CC(C)CC(NC1CCCC(C)CC1)C(=O)N(C)C.
What is the InChIKey of N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide?
The InChIKey is IELVCIMVEJMIIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-12(2)11-15(16(19)18(4)5)17-14-8-6-7-13(3)9-10-14/h12-15,17H,6-11H2,1-5H3.
What are the key properties of N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide?
N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide has a molecular weight of 268.44 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide is sourced from PubChem (CID 65080591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).