N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine

C13H26N2 — CID 103068881

IUPACN-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine
SMILESC=C(CNC1CC1)CN(CCC)CCC
InChIInChI=1S/C13H26N2/c1-4-8-15(9-5-2)11-12(3)10-14-13-6-7-13/h13-14H,3-11H2,1-2H3
InChIKeySVJFYKAPTNJVHB-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.42
Rot. Bonds9

About N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine

N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine (PubChem CID 103068881) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine
PubChem CID103068881
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine
SMILESC=C(CNC1CC1)CN(CCC)CCC
InChIInChI=1S/C13H26N2/c1-4-8-15(9-5-2)11-12(3)10-14-13-6-7-13/h13-14H,3-11H2,1-2H3
InChIKeySVJFYKAPTNJVHB-UHFFFAOYSA-N
XLogP2.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-[2-[(cyclopropylamino)methyl]prop-2-enyl-(2-methoxyethyl)amino]propanenitrile
CID 103070598
3-[2-[(cyclopropylamino)methyl]prop-2-enyl-(2-methylpropyl)amino]propanenitrile
CID 103070162
N-cyclopropyl-N'-(2-methoxyethyl)-2-methylidene-N'-(2-methylpropyl)propane-1,3-diamine
CID 103069901
N-cyclopentyl-N'-cyclopropyl-N-ethyl-2-methylidenepropane-1,3-diamine
CID 103069362
N-butan-2-yl-N'-cyclopropyl-N-ethyl-2-methylidenepropane-1,3-diamine
CID 103069214
N-[2-(butoxymethyl)prop-2-enyl]cyclopropanamine
CID 103074641
N-butan-2-yl-N'-cyclopropyl-N-(2-methoxyethyl)-2-methylidenepropane-1,3-diamine
CID 103070042
3-[cyclobutyl-[2-[(cyclopropylamino)methyl]prop-2-enyl]amino]propan-1-ol
CID 103071461
N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine
CID 103070072
N-(2-methylidenebutyl)cycloheptanamine
CID 66045688
N,N-dibutyl-N'-methyl-2-methylidenepropane-1,3-diamine
CID 103069188
N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine
CID 103074416

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine (CID 103068881) is N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine is C=C(CNC1CC1)CN(CCC)CCC.
What is the InChIKey of N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine?
The InChIKey is SVJFYKAPTNJVHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-4-8-15(9-5-2)11-12(3)10-14-13-6-7-13/h13-14H,3-11H2,1-2H3.
What are the key properties of N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine?
N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine has a molecular weight of 210.36 g/mol, XLogP of 2.42, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine is sourced from PubChem (CID 103068881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).