2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine

C11H24N2 — CID 62692906

IUPAC2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine
SMILESCCC(C)CNCC(C)(N)C1CC1
InChIInChI=1S/C11H24N2/c1-4-9(2)7-13-8-11(3,12)10-5-6-10/h9-10,13H,4-8,12H2,1-3H3
InChIKeyMLWBBQYXXIZSPN-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.75
Rot. Bonds6

About 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine

2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine (PubChem CID 62692906) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine
PubChem CID62692906
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine
SMILESCCC(C)CNCC(C)(N)C1CC1
InChIInChI=1S/C11H24N2/c1-4-9(2)7-13-8-11(3,12)10-5-6-10/h9-10,13H,4-8,12H2,1-3H3
InChIKeyMLWBBQYXXIZSPN-UHFFFAOYSA-N
XLogP1.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-cyclopropyl-N-(2-methylbutyl)propanamide
CID 62694160
N-(cyclopentylmethyl)-2-methylbutan-1-amine
CID 43370775
2-N-ethyl-2-methyl-1-N-(2-methylbutyl)propane-1,2-diamine
CID 62835035
1-N-butan-2-yl-2-cyclopropyl-1-N-ethylpropane-1,2-diamine
CID 60868279
N-ethyl-2,2-dimethylbutan-1-amine;N-ethyl-2-methylbutan-1-amine
CID 163239092
(2S)-2-cyclopropylbutan-2-amine
CID 93299299
N'-[2-(2-methylbutylamino)ethyl]-N-[2-[2-(2-methylbutylamino)ethylamino]ethyl]ethane-1,2-diamine
CID 87768020
N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
CID 115198967
2-cyclopropyl-2,4-dimethyl-N-propylhexan-1-amine
CID 83160326
3-cyclopropylbutane-1,3-diamine
CID 150088317
1-N-cycloheptyl-2-cyclopropylpropane-1,2-diamine
CID 61151525
1-N-cyclohexyl-2-cyclopropylpropane-1,2-diamine
CID 61150481

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
The IUPAC name of 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine (CID 62692906) is 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine.
What is the SMILES notation for 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
The canonical SMILES for 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine is CCC(C)CNCC(C)(N)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
The InChIKey is MLWBBQYXXIZSPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-9(2)7-13-8-11(3,12)10-5-6-10/h9-10,13H,4-8,12H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine is sourced from PubChem (CID 62692906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).