N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide

C13H26N2O2 — CID 106124719

IUPACN-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide
SMILESCOC(C)CCC(=O)NCC1CCC(N)CC1
InChIInChI=1S/C13H26N2O2/c1-10(17-2)3-8-13(16)15-9-11-4-6-12(14)7-5-11/h10-12H,3-9,14H2,1-2H3,(H,15,16)
InChIKeyDVNJRCHFOFWHDR-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.44
Rot. Bonds6

About N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide

N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide (PubChem CID 106124719) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide.

Molecular Properties

Compound NameN-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide
PubChem CID106124719
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide
SMILESCOC(C)CCC(=O)NCC1CCC(N)CC1
InChIInChI=1S/C13H26N2O2/c1-10(17-2)3-8-13(16)15-9-11-4-6-12(14)7-5-11/h10-12H,3-9,14H2,1-2H3,(H,15,16)
InChIKeyDVNJRCHFOFWHDR-UHFFFAOYSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide
CID 103280773
N-[(4-aminocyclohexyl)methyl]pentanamide
CID 106124302
N-[[4-(aminomethyl)cyclohexyl]methyl]-4-methylpentanamide
CID 114231575
4-amino-N-[(4-ethylcyclohexyl)methyl]pentanamide;hydrochloride
CID 120561038
N-[(4-aminocyclohexyl)methyl]-3,4,4-trimethylpentanamide
CID 106124369
N-[(4-bromocyclohexyl)methyl]-4-methylpentanamide
CID 106134835
N-[(4-aminocyclohexyl)methyl]-3-cyclohexylpropanamide
CID 106124035
4-methoxy-N-[(4-methylpiperidin-3-yl)methyl]pentanamide
CID 114955742
2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide
CID 62782345
4-methyl-N-(piperidin-4-ylmethyl)pentanamide
CID 28779882
2-[4-aminobutan-2-yl(methyl)amino]-N-(cyclopropylmethyl)acetamide
CID 63225580
4-(2-aminoethyl)-N-[(4-hydroxycyclohexyl)methyl]-5,5-dimethylhexanamide
CID 106135446

Frequently Asked Questions

What is the IUPAC name of N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide?
The IUPAC name of N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide (CID 106124719) is N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide.
What is the SMILES notation for N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide?
The canonical SMILES for N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide is COC(C)CCC(=O)NCC1CCC(N)CC1.
What is the InChIKey of N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide?
The InChIKey is DVNJRCHFOFWHDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(17-2)3-8-13(16)15-9-11-4-6-12(14)7-5-11/h10-12H,3-9,14H2,1-2H3,(H,15,16).
What are the key properties of N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide?
N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide has a molecular weight of 242.36 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide is sourced from PubChem (CID 106124719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).