2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine

C14H30N2O — CID 61448059

IUPAC2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine
SMILESCCCC1CCC(N)C(N(CC)CCOC)C1
InChIInChI=1S/C14H30N2O/c1-4-6-12-7-8-13(15)14(11-12)16(5-2)9-10-17-3/h12-14H,4-11,15H2,1-3H3
InChIKeyNELVDNFFECKKTC-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.25
Rot. Bonds7

About 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine

2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine (PubChem CID 61448059) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine
PubChem CID61448059
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine
SMILESCCCC1CCC(N)C(N(CC)CCOC)C1
InChIInChI=1S/C14H30N2O/c1-4-6-12-7-8-13(15)14(11-12)16(5-2)9-10-17-3/h12-14H,4-11,15H2,1-3H3
InChIKeyNELVDNFFECKKTC-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 62608938
2-[[3-methoxypropyl(methyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 63007747
2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine
CID 54932445
2-N-(2-ethoxyethyl)-1-N,2-N-diethyl-4-propylcyclohexane-1,2-diamine
CID 63697377
2-[3-(2-methoxyethoxy)propyl]-4-propylcyclohexan-1-amine
CID 103410732
2-N-(cyclopropylmethyl)-2-N,4-diethylcyclohexane-1,2-diamine
CID 63955967
2-[2-methoxyethyl(pentan-3-yl)amino]-4-propylcyclohexane-1-carbonitrile
CID 63512784
2-N,4-diethyl-2-N-(1-methoxypropan-2-yl)cyclohexane-1,2-diamine
CID 55011662
2-[[ethyl(2-methoxyethyl)amino]methyl]-N,4-dipropylcyclohexan-1-amine
CID 63495212
2-[[2-(aminomethyl)-5-propylcyclohexyl]-propylamino]ethanol
CID 61424771
2-(propoxymethyl)-4-propylcyclohexan-1-amine
CID 81013169
2-[[cyclopropyl(propyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 55093550

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine?
The IUPAC name of 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine (CID 61448059) is 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine is CCCC1CCC(N)C(N(CC)CCOC)C1.
What is the InChIKey of 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine?
The InChIKey is NELVDNFFECKKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-4-6-12-7-8-13(15)14(11-12)16(5-2)9-10-17-3/h12-14H,4-11,15H2,1-3H3.
What are the key properties of 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine?
2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine has a molecular weight of 242.41 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine is sourced from PubChem (CID 61448059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).