1-cyclodecyl-N'-ethyl-N'-methylmethanediamine

C14H30N2 — CID 163495055

IUPAC1-cyclodecyl-N'-ethyl-N'-methylmethanediamine
SMILESCCN(C)C(N)C1CCCCCCCCC1
InChIInChI=1S/C14H30N2/c1-3-16(2)14(15)13-11-9-7-5-4-6-8-10-12-13/h13-14H,3-12,15H2,1-2H3
InChIKeyCPZAHYLRMKJQCP-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.36
Rot. Bonds3

About 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine

1-cyclodecyl-N'-ethyl-N'-methylmethanediamine (PubChem CID 163495055) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine.

Molecular Properties

Compound Name1-cyclodecyl-N'-ethyl-N'-methylmethanediamine
PubChem CID163495055
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-cyclodecyl-N'-ethyl-N'-methylmethanediamine
SMILESCCN(C)C(N)C1CCCCCCCCC1
InChIInChI=1S/C14H30N2/c1-3-16(2)14(15)13-11-9-7-5-4-6-8-10-12-13/h13-14H,3-12,15H2,1-2H3
InChIKeyCPZAHYLRMKJQCP-UHFFFAOYSA-N
XLogP3.36
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-cyclopentyl-N',N'-dimethylmethanediamine
CID 116909168
N-(dicyclohexylmethyl)-N-ethylethanamine
CID 10220617
N'-butan-2-yl-1-cyclopentyl-N'-methylethane-1,2-diamine
CID 104744720
1-cyclohexyl-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 79064562
1-cyclohexyl-N'-cyclopentyl-N'-ethylethane-1,2-diamine
CID 104744777
2-cyclohexylpentan-3-amine
CID 79308576
1-cyclopentyl-N'-methyl-N'-(4-methylpentan-2-yl)ethane-1,2-diamine
CID 104745466
1-cyclopropyl-N-ethyl-N-methylethanamine
CID 126664134
1-cyclohexyl-N'-(3,3-dimethylbutan-2-yl)-N'-methylethane-1,2-diamine
CID 113448166
N',1-dicyclopentyl-N'-ethylethane-1,2-diamine
CID 104744779
cycloheptyl(cyclohexyl)methanamine
CID 65399873
cyclohexyl(ethylsulfonyl)methanamine
CID 54085731

Frequently Asked Questions

What is the IUPAC name of 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine?
The IUPAC name of 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine (CID 163495055) is 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine.
What is the SMILES notation for 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine?
The canonical SMILES for 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine is CCN(C)C(N)C1CCCCCCCCC1.
What is the InChIKey of 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine?
The InChIKey is CPZAHYLRMKJQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-3-16(2)14(15)13-11-9-7-5-4-6-8-10-12-13/h13-14H,3-12,15H2,1-2H3.
What are the key properties of 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine?
1-cyclodecyl-N'-ethyl-N'-methylmethanediamine has a molecular weight of 226.41 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclodecyl-N'-ethyl-N'-methylmethanediamine is sourced from PubChem (CID 163495055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).