6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide

C13H25N3O — CID 64520123

IUPAC6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide
SMILESNNC(=O)CCCCCN(CC1CC1)C1CC1
InChIInChI=1S/C13H25N3O/c14-15-13(17)4-2-1-3-9-16(12-7-8-12)10-11-5-6-11/h11-12H,1-10,14H2,(H,15,17)
InChIKeyQQPLXJNBGPAOED-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.41
Rot. Bonds9

About 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide

6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide (PubChem CID 64520123) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide.

Molecular Properties

Compound Name6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide
PubChem CID64520123
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide
SMILESNNC(=O)CCCCCN(CC1CC1)C1CC1
InChIInChI=1S/C13H25N3O/c14-15-13(17)4-2-1-3-9-16(12-7-8-12)10-11-5-6-11/h11-12H,1-10,14H2,(H,15,17)
InChIKeyQQPLXJNBGPAOED-UHFFFAOYSA-N
XLogP1.41
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-[cyclobutyl(3-hydroxypropyl)amino]hexanehydrazide
CID 102873673
5-[cyclopropylmethyl(ethyl)amino]pentanehydrazide
CID 63940685
5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide
CID 107402397
3-[cyclopropylmethyl(methyl)amino]propanehydrazide
CID 63571724
6-[cyclopropyl(cyclopropylmethyl)amino]-2-methyl-2-(methylamino)hexanamide
CID 64522437
N'-cyclopropyl-N'-(cyclopropylmethyl)-N-methylbutane-1,4-diamine
CID 64522169
6-[methyl(oxolan-3-yl)amino]hexanehydrazide
CID 82753777
4-[cycloheptyl(methyl)amino]butanehydrazide
CID 63571638
4-[cyclohexyl(methyl)amino]butanehydrazide
CID 63568701
4-[cyclopropyl(cyclopropylmethyl)amino]-2-(propylamino)butanamide
CID 64521638
5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid
CID 65254953
2-(cyclopropylamino)-6-[cyclopropyl(cyclopropylmethyl)amino]-2-methylhexanoic acid
CID 64521035

Frequently Asked Questions

What is the IUPAC name of 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide?
The IUPAC name of 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide (CID 64520123) is 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide.
What is the SMILES notation for 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide?
The canonical SMILES for 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide is NNC(=O)CCCCCN(CC1CC1)C1CC1.
What is the InChIKey of 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide?
The InChIKey is QQPLXJNBGPAOED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c14-15-13(17)4-2-1-3-9-16(12-7-8-12)10-11-5-6-11/h11-12H,1-10,14H2,(H,15,17).
What are the key properties of 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide?
6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide has a molecular weight of 239.36 g/mol, XLogP of 1.41, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide is sourced from PubChem (CID 64520123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).