N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine

C11H25N3 — CID 114524959

IUPACN'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine
SMILESCN(C)CCCN(CCCN)C1CC1
InChIInChI=1S/C11H25N3/c1-13(2)8-4-10-14(9-3-7-12)11-5-6-11/h11H,3-10,12H2,1-2H3
InChIKeyIQPYMJYPZMMYTJ-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.75
Rot. Bonds8

About N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine

N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine (PubChem CID 114524959) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine
PubChem CID114524959
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC NameN'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine
SMILESCN(C)CCCN(CCCN)C1CC1
InChIInChI=1S/C11H25N3/c1-13(2)8-4-10-14(9-3-7-12)11-5-6-11/h11H,3-10,12H2,1-2H3
InChIKeyIQPYMJYPZMMYTJ-UHFFFAOYSA-N
XLogP0.75
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-Diisopropyl-1,3-propanediamine
CID 144018
N1,N1-Dimethyl-N3-(1-methylethyl)-1,3-propanediamine
CID 198460
N1-Cyclopropyl-N1-(1-methylethyl)-1,2-ethanediamine
CID 10419294
N1,N1-Diethyl-1,3-butanediamine
CID 12639039
N-(2-aminoethyl)-N-ethylcyclopropanamine
CID 10396864
N~1~,N~1~-Di(propan-2-yl)propane-1,3-diamine
CID 13802779
(3-Aminopropyl)(methyl)(propan-2-yl)amine
CID 16781009
N-(3-amino-1-methylpropyl)-N-ethyl-N-methylamine
CID 25219172
N-(3-aminopropyl)-N-methylcyclopropanamine
CID 43137481
N-methyl-N-[2-(methylamino)ethyl]cyclopropanamine
CID 43265091
N-[3-(methylamino)propyl]-N-(propan-2-yl)cyclopropanamine
CID 59289514
(4-Aminobutan-2-yl)(methyl)propylamine
CID 60912978

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine?
The IUPAC name of N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine (CID 114524959) is N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine?
The canonical SMILES for N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine is CN(C)CCCN(CCCN)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine?
The InChIKey is IQPYMJYPZMMYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-13(2)8-4-10-14(9-3-7-12)11-5-6-11/h11H,3-10,12H2,1-2H3.
What are the key properties of N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine?
N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine has a molecular weight of 199.34 g/mol, XLogP of 0.75, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine is sourced from PubChem (CID 114524959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).