2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine

C15H32N2 — CID 54932445

IUPAC2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine
SMILESCCCC1CCC(N)C(N(CCC)C(C)C)C1
InChIInChI=1S/C15H32N2/c1-5-7-13-8-9-14(16)15(11-13)17(10-6-2)12(3)4/h12-15H,5-11,16H2,1-4H3
InChIKeyYXAMYMPONODGQG-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.40
Rot. Bonds6

About 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine

2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine (PubChem CID 54932445) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine
PubChem CID54932445
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine
SMILESCCCC1CCC(N)C(N(CCC)C(C)C)C1
InChIInChI=1S/C15H32N2/c1-5-7-13-8-9-14(16)15(11-13)17(10-6-2)12(3)4/h12-15H,5-11,16H2,1-4H3
InChIKeyYXAMYMPONODGQG-UHFFFAOYSA-N
XLogP3.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-2-N-propan-2-yl-2-N-propylcyclohexane-1,2-diamine
CID 43269484
2-N,4-diethyl-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 43265755
2-N-propan-2-yl-2-N-propylcyclododecane-1,2-diamine
CID 43269481
4-ethyl-2-N-(2-methylpropyl)-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 54999761
3-[propan-2-yl(propyl)amino]-4-propylcyclohexan-1-ol
CID 165497914
2-N-ethyl-2-N-(2-methoxyethyl)-4-propylcyclohexane-1,2-diamine
CID 61448059
1-N-propan-2-yl-1-N-propylcyclobutane-1,3-diamine
CID 80561596
4-ethyl-2-N-methyl-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 16781866
4-ethyl-2-N-propan-2-yl-1-N,2-N-dipropylcyclohexane-1,2-diamine
CID 63464854
2-[[cyclopropyl(propyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 55093550
2-N-methyl-2-N-(2-methyloxolan-3-yl)-4-propylcyclohexane-1,2-diamine
CID 82734835
2-N-methyl-2-N-[(1-methylpiperidin-4-yl)methyl]-4-propylcyclohexane-1,2-diamine
CID 63233108

Frequently Asked Questions

What is the IUPAC name of 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine?
The IUPAC name of 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine (CID 54932445) is 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine.
What is the SMILES notation for 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine?
The canonical SMILES for 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine is CCCC1CCC(N)C(N(CCC)C(C)C)C1.
What is the InChIKey of 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine?
The InChIKey is YXAMYMPONODGQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-5-7-13-8-9-14(16)15(11-13)17(10-6-2)12(3)4/h12-15H,5-11,16H2,1-4H3.
What are the key properties of 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine?
2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine has a molecular weight of 240.43 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-propan-2-yl-2-N,4-dipropylcyclohexane-1,2-diamine is sourced from PubChem (CID 54932445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).