(Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine

C10H21N3 — CID 126488966

IUPAC(Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine
SMILESC=N/C(=C\NC)CCCNC(C)C
InChIInChI=1S/C10H21N3/c1-9(2)13-7-5-6-10(12-4)8-11-3/h8-9,11,13H,4-7H2,1-3H3/b10-8-
InChIKeyJAGSJUSSQZRLRN-NTMALXAHSA-N
MW183.30 g/mol
LogP1.53
Rot. Bonds7

About (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine

(Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine (PubChem CID 126488966) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine.

Molecular Properties

Compound Name(Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine
PubChem CID126488966
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name(Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine
SMILESC=N/C(=C\NC)CCCNC(C)C
InChIInChI=1S/C10H21N3/c1-9(2)13-7-5-6-10(12-4)8-11-3/h8-9,11,13H,4-7H2,1-3H3/b10-8-
InChIKeyJAGSJUSSQZRLRN-NTMALXAHSA-N
XLogP1.53
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine?
The IUPAC name of (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine (CID 126488966) is (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine.
What is the SMILES notation for (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine?
The canonical SMILES for (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine is C=N/C(=C\NC)CCCNC(C)C.
What is the InChIKey of (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine?
The InChIKey is JAGSJUSSQZRLRN-NTMALXAHSA-N. The full InChI is InChI=1S/C10H21N3/c1-9(2)13-7-5-6-10(12-4)8-11-3/h8-9,11,13H,4-7H2,1-3H3/b10-8-.
What are the key properties of (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine?
(Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine has a molecular weight of 183.30 g/mol, XLogP of 1.53, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methyl-2-(methylideneamino)-N'-propan-2-ylpent-1-ene-1,5-diamine is sourced from PubChem (CID 126488966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).