N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine

C15H26N2O — CID 62259472

IUPACN-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine
SMILESCCC(C)(CNC1CC1)CN(C)Cc1ccoc1
InChIInChI=1S/C15H26N2O/c1-4-15(2,11-16-14-5-6-14)12-17(3)9-13-7-8-18-10-13/h7-8,10,14,16H,4-6,9,11-12H2,1-3H3
InChIKeyORFGEXOLGCRXHH-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.88
Rot. Bonds8

About N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine

N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine (PubChem CID 62259472) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine
PubChem CID62259472
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine
SMILESCCC(C)(CNC1CC1)CN(C)Cc1ccoc1
InChIInChI=1S/C15H26N2O/c1-4-15(2,11-16-14-5-6-14)12-17(3)9-13-7-8-18-10-13/h7-8,10,14,16H,4-6,9,11-12H2,1-3H3
InChIKeyORFGEXOLGCRXHH-UHFFFAOYSA-N
XLogP2.88
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine
CID 62260161
N-cyclopropyl-2-ethyl-N'-[(3-methoxyphenyl)methyl]-N',2-dimethylpropane-1,3-diamine
CID 62271920
N-[(5-bromothiophen-3-yl)methyl]-N'-cyclopropyl-2-ethyl-N,2-dimethylpropane-1,3-diamine
CID 62260869
N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-propylpropane-1,3-diamine
CID 62263465
N-benzyl-N'-tert-butyl-2-ethyl-N,2-dimethylpropane-1,3-diamine
CID 62262100
N-(furan-3-ylmethyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 63424145
N-[[4-[[furan-3-ylmethyl(methyl)amino]methyl]-1,3-thiazol-2-yl]methyl]cyclopropanamine
CID 62462542
N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine
CID 63864351
N-[2-(furan-3-ylmethyl)-2-methylbut-3-enyl]cyclopropanamine
CID 102641139
3-[furan-3-ylmethyl(methyl)amino]-2,2-dimethylpropanal
CID 62275696
2-ethyl-2-[[furan-3-ylmethyl(methyl)amino]methyl]butanoic acid
CID 62271233
N-cyclopropyl-N'-[3-(dimethylamino)propyl]-N',2-diethyl-2-methylpropane-1,3-diamine
CID 102997075

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine (CID 62259472) is N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine is CCC(C)(CNC1CC1)CN(C)Cc1ccoc1.
What is the InChIKey of N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine?
The InChIKey is ORFGEXOLGCRXHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-4-15(2,11-16-14-5-6-14)12-17(3)9-13-7-8-18-10-13/h7-8,10,14,16H,4-6,9,11-12H2,1-3H3.
What are the key properties of N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine?
N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.88, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-ethyl-N'-(furan-3-ylmethyl)-N',2-dimethylpropane-1,3-diamine is sourced from PubChem (CID 62259472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).