4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine

C15H32N2 — CID 54999761

IUPAC4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine
SMILESCCC1CCC(N)C(N(CC(C)C)C(C)C)C1
InChIInChI=1S/C15H32N2/c1-6-13-7-8-14(16)15(9-13)17(12(4)5)10-11(2)3/h11-15H,6-10,16H2,1-5H3
InChIKeyPBDGSVBCICNDRK-UHFFFAOYSA-N
MW240.44 g/mol
LogP3.26
Rot. Bonds5

About 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine

4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine (PubChem CID 54999761) has the molecular formula C15H32N2 and a molecular weight of 240.44 g/mol. Its IUPAC name is 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine
PubChem CID54999761
Molecular FormulaC15H32N2
Molecular Weight240.44 g/mol
Exact Mass240.26
IUPAC Name4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine
SMILESCCC1CCC(N)C(N(CC(C)C)C(C)C)C1
InChIInChI=1S/C15H32N2/c1-6-13-7-8-14(16)15(9-13)17(12(4)5)10-11(2)3/h11-15H,6-10,16H2,1-5H3
InChIKeyPBDGSVBCICNDRK-UHFFFAOYSA-N
XLogP3.26
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.44
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N,4-diethyl-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 43265755
4-ethyl-2-N-methyl-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 16781866
2-N-cyclopropyl-4-ethyl-2-N-(3-methylbutyl)cyclohexane-1,2-diamine
CID 78974066
2-N,4-diethyl-2-N-(1-methoxypropan-2-yl)cyclohexane-1,2-diamine
CID 55011662
2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine
CID 54932445
2-N,4-diethyl-2-N-methylcyclohexane-1,2-diamine
CID 43263387
4-ethyl-2-N-methyl-2-N-(2-methylbutan-2-yl)cyclohexane-1,2-diamine
CID 63980553
2-N-(cyclopropylmethyl)-2-N,4-diethylcyclohexane-1,2-diamine
CID 63955967
2-(aminomethyl)-N-cyclopropyl-5-ethyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 55002153
4-methyl-2-N-propan-2-yl-2-N-propylcyclohexane-1,2-diamine
CID 43269484
1-N-(2-methylpropyl)-1-N-propan-2-ylcyclohexane-1,3-diamine
CID 79469037
3-[2-methylpropyl(propan-2-yl)amino]-4-propylcyclohexan-1-ol
CID 165497893

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine?
The IUPAC name of 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine (CID 54999761) is 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine.
What is the SMILES notation for 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine?
The canonical SMILES for 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine is CCC1CCC(N)C(N(CC(C)C)C(C)C)C1.
What is the InChIKey of 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine?
The InChIKey is PBDGSVBCICNDRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-13-7-8-14(16)15(9-13)17(12(4)5)10-11(2)3/h11-15H,6-10,16H2,1-5H3.
What are the key properties of 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine?
4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine has a molecular weight of 240.44 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine is sourced from PubChem (CID 54999761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).