N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine

C11H22N2 — CID 103069258

IUPACN-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine
SMILESC=C(CNCC)CN(CC)C1CC1
InChIInChI=1S/C11H22N2/c1-4-12-8-10(3)9-13(5-2)11-6-7-11/h11-12H,3-9H2,1-2H3
InChIKeyRVVVPJGMKCXZOW-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.64
Rot. Bonds7

About N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine

N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine (PubChem CID 103069258) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine
PubChem CID103069258
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine
SMILESC=C(CNCC)CN(CC)C1CC1
InChIInChI=1S/C11H22N2/c1-4-12-8-10(3)9-13(5-2)11-6-7-11/h11-12H,3-9H2,1-2H3
InChIKeyRVVVPJGMKCXZOW-UHFFFAOYSA-N
XLogP1.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.64
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

N-cyclopropyl-N'-ethyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine
CID 103070025
N-cyclopropyl-N'-ethyl-N-(3-methylbutyl)-2-methylidenepropane-1,3-diamine
CID 103070074
2-[cyclopentyl-[2-(ethylaminomethyl)prop-2-enyl]amino]ethanol
CID 103070001
N-cyclopentyl-N'-cyclopropyl-N-ethyl-2-methylidenepropane-1,3-diamine
CID 103069362
N-ethyl-N'-methyl-2-methylidene-N'-(1-methylpiperidin-4-yl)propane-1,3-diamine
CID 103068902
N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine
CID 103070023
N-butyl-N-cyclopropyl-2-methylidene-N'-propan-2-ylpropane-1,3-diamine
CID 103069805
N-tert-butyl-N'-butyl-N'-cyclopropyl-2-methylidenepropane-1,3-diamine
CID 103069808
N'-cyclopropyl-N,N'-diethylpentane-1,5-diamine
CID 62421283
2-[[cyclopropyl(propyl)amino]methyl]prop-2-ene-1-thiol
CID 103073276
N-[2-(dimethylamino)ethyl]-N'-ethyl-N-methyl-2-methylidenepropane-1,3-diamine
CID 103070658
3-[cyclobutyl-[2-(methylaminomethyl)prop-2-enyl]amino]propan-1-ol
CID 103071457

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine (CID 103069258) is N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine is C=C(CNCC)CN(CC)C1CC1.
What is the InChIKey of N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine?
The InChIKey is RVVVPJGMKCXZOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-4-12-8-10(3)9-13(5-2)11-6-7-11/h11-12H,3-9H2,1-2H3.
What are the key properties of N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine?
N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine has a molecular weight of 182.31 g/mol, XLogP of 1.64, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine is sourced from PubChem (CID 103069258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).