4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine

C11H24N2 — CID 64707187

IUPAC4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine
SMILESCC(N)CC(C)N(C)C(C)C1CC1
InChIInChI=1S/C11H24N2/c1-8(12)7-9(2)13(4)10(3)11-5-6-11/h8-11H,5-7,12H2,1-4H3
InChIKeyGWHRBSCWODVZIZ-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.84
Rot. Bonds5

About 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine

4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine (PubChem CID 64707187) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine.

Molecular Properties

Compound Name4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine
PubChem CID64707187
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine
SMILESCC(N)CC(C)N(C)C(C)C1CC1
InChIInChI=1S/C11H24N2/c1-8(12)7-9(2)13(4)10(3)11-5-6-11/h8-11H,5-7,12H2,1-4H3
InChIKeyGWHRBSCWODVZIZ-UHFFFAOYSA-N
XLogP1.84
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine?
The IUPAC name of 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine (CID 64707187) is 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine.
What is the SMILES notation for 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine?
The canonical SMILES for 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine is CC(N)CC(C)N(C)C(C)C1CC1.
What is the InChIKey of 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine?
The InChIKey is GWHRBSCWODVZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-8(12)7-9(2)13(4)10(3)11-5-6-11/h8-11H,5-7,12H2,1-4H3.
What are the key properties of 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine?
4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1-cyclopropylethyl)-4-N-methylpentane-2,4-diamine is sourced from PubChem (CID 64707187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).