N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine

C18H36AlN3 — CID 140655995

IUPACN-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine
SMILESCCCN(C1CC1)[Al](N(CCC)C1CC1)N(CCC)C1CC1
InChIInChI=1S/3C6H12N.Al/c3*1-2-5-7-6-3-4-6;/h3*6H,2-5H2,1H3;/q3*-1;+3
InChIKeyLEPDGMSWTZDHJJ-UHFFFAOYSA-N
MW321.49 g/mol
LogP3.59
Rot. Bonds12

About N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine

N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine (PubChem CID 140655995) has the molecular formula C18H36AlN3 and a molecular weight of 321.49 g/mol. Its IUPAC name is N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine.

Molecular Properties

Compound NameN-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine
PubChem CID140655995
Molecular FormulaC18H36AlN3
Molecular Weight321.49 g/mol
Exact Mass321.27
IUPAC NameN-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine
SMILESCCCN(C1CC1)[Al](N(CCC)C1CC1)N(CCC)C1CC1
InChIInChI=1S/3C6H12N.Al/c3*1-2-5-7-6-3-4-6;/h3*6H,2-5H2,1H3;/q3*-1;+3
InChIKeyLEPDGMSWTZDHJJ-UHFFFAOYSA-N
XLogP3.59
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.49
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[cyclopentyl(propyl)amino]disulfanyl]-N-propylcyclopentanamine
CID 130246594
1-(4-methylcyclohexyl)-1-propylhydrazine
CID 70209412
N-cyclopropyl-N-propylcarbamoyl bromide
CID 140982146
N-cyclopropyl-N-pentylcyclopropanamine
CID 91246836
N,N-dipropylcyclodecanamine
CID 139723962
1-cyclopentyl-1-propylhydrazine
CID 90722270
1-[cyclopropyl(propyl)amino]propan-2-ol
CID 60886554
4-ethoxy-N-methyl-N-propylcyclohexan-1-amine
CID 166800579
potassium 3-[cyclopropyl(propyl)amino]prop-1-en-2-yl-trifluoroboranuide
CID 106745699
4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine
CID 60850888
4-N-cycloheptyl-4-N-propylcyclohexane-1,4-diamine
CID 79111561
6-methyl-N,N-dipropylpiperidin-3-amine
CID 63158111

Frequently Asked Questions

What is the IUPAC name of N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine?
The IUPAC name of N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine (CID 140655995) is N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine.
What is the SMILES notation for N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine?
The canonical SMILES for N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine is CCCN(C1CC1)[Al](N(CCC)C1CC1)N(CCC)C1CC1.
What is the InChIKey of N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine?
The InChIKey is LEPDGMSWTZDHJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H12N.Al/c3*1-2-5-7-6-3-4-6;/h3*6H,2-5H2,1H3;/q3*-1;+3.
What are the key properties of N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine?
N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine has a molecular weight of 321.49 g/mol, XLogP of 3.59, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-bis[cyclopropyl(propyl)amino]alumanyl-N-propylcyclopropanamine is sourced from PubChem (CID 140655995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).