N,N-dibenzyl-1-cyclopropylethane-1,2-diamine

C19H24N2 — CID 43655032

IUPACN,N-dibenzyl-1-cyclopropylethane-1,2-diamine
SMILESNCC(C1CC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C19H24N2/c20-13-19(18-11-12-18)21(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-10,18-19H,11-15,20H2
InChIKeySOELUCDEQJUWKD-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.43
Rot. Bonds7

About N,N-dibenzyl-1-cyclopropylethane-1,2-diamine

N,N-dibenzyl-1-cyclopropylethane-1,2-diamine (PubChem CID 43655032) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N,N-dibenzyl-1-cyclopropylethane-1,2-diamine.

Molecular Properties

Compound NameN,N-dibenzyl-1-cyclopropylethane-1,2-diamine
PubChem CID43655032
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN,N-dibenzyl-1-cyclopropylethane-1,2-diamine
SMILESNCC(C1CC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C19H24N2/c20-13-19(18-11-12-18)21(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-10,18-19H,11-15,20H2
InChIKeySOELUCDEQJUWKD-UHFFFAOYSA-N
XLogP3.43
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dibenzyl-1-cyclopentylethane-1,2-diamine
CID 130158926
1-cyclopropyl-N-ethyl-N-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 61450542
N'-benzyl-1-cyclopropyl-N'-propan-2-ylethane-1,2-diamine
CID 130758158
1-cyclopentyl-N-ethyl-N-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 55034763
1-N-benzyl-1-N-(1-cyclopropylethyl)propane-1,2-diamine;hydrochloride
CID 120980321
2-[benzyl-[(E)-3-chloroprop-2-enyl]amino]-2-cyclopropylethanol
CID 109397397
1-(2-amino-1-cyclopropylethyl)-3-benzyl-1-methylurea
CID 107654315
2-[benzyl-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]amino]-2-cyclopropylethanol
CID 109397382
2-[benzyl-[(2-chloro-3-pyridinyl)methyl]amino]-2-cyclopropylethanol
CID 109397389
1-cyclopropyl-N,N-diethylethane-1,2-diamine
CID 43654980
2-benzyl-N'-cyclopropylpropane-1,3-diamine
CID 117241556
2-[1-aminopropan-2-yl(benzyl)amino]ethanol
CID 62116860

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-1-cyclopropylethane-1,2-diamine?
The IUPAC name of N,N-dibenzyl-1-cyclopropylethane-1,2-diamine (CID 43655032) is N,N-dibenzyl-1-cyclopropylethane-1,2-diamine.
What is the SMILES notation for N,N-dibenzyl-1-cyclopropylethane-1,2-diamine?
The canonical SMILES for N,N-dibenzyl-1-cyclopropylethane-1,2-diamine is NCC(C1CC1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-1-cyclopropylethane-1,2-diamine?
The InChIKey is SOELUCDEQJUWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c20-13-19(18-11-12-18)21(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-10,18-19H,11-15,20H2.
What are the key properties of N,N-dibenzyl-1-cyclopropylethane-1,2-diamine?
N,N-dibenzyl-1-cyclopropylethane-1,2-diamine has a molecular weight of 280.42 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-1-cyclopropylethane-1,2-diamine is sourced from PubChem (CID 43655032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).