5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide

C14H29N3 — CID 65258573

IUPAC5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCN(CC(C)C)C1CC1
InChIInChI=1S/C14H29N3/c1-11(2)10-17(12-6-7-12)9-5-8-14(3,4)13(15)16/h11-12H,5-10H2,1-4H3,(H3,15,16)
InChIKeyZVHGVBQSKRYDRW-UHFFFAOYSA-N
MW239.41 g/mol
LogP2.85
Rot. Bonds8

About 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide

5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide (PubChem CID 65258573) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide.

Molecular Properties

Compound Name5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide
PubChem CID65258573
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCN(CC(C)C)C1CC1
InChIInChI=1S/C14H29N3/c1-11(2)10-17(12-6-7-12)9-5-8-14(3,4)13(15)16/h11-12H,5-10H2,1-4H3,(H3,15,16)
InChIKeyZVHGVBQSKRYDRW-UHFFFAOYSA-N
XLogP2.85
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

6-[cyclopropyl(ethyl)amino]-2,2-dimethylhexanimidamide
CID 106711942
5-[cyclohexyl(ethyl)amino]-2,2-dimethylpentanimidamide
CID 65258758
5-[cyclopentyl(2-hydroxyethyl)amino]-2,2-dimethylpentanimidamide
CID 65258525
1-amino-5-[cyclopropyl(2-methylpropyl)amino]-2-methylpentan-2-ol
CID 64818670
6-[cyclohexyl(2-hydroxyethyl)amino]-2,2-dimethylhexanimidamide
CID 106712040
2,2-dimethyl-6-[2-methylpropyl(propan-2-yl)amino]hexanimidamide
CID 106712046
2,2-dimethyl-5-[pentyl(propan-2-yl)amino]pentanimidamide
CID 65258572
4-[1-cyclopropylethyl(methyl)amino]-2,2-dimethylbutanimidamide
CID 65252117
6-[butan-2-yl(methyl)amino]-2,2-dimethylhexanimidamide
CID 106711950
2,2-dimethyl-5-[propan-2-yl(2,2,2-trifluoroethyl)amino]pentanimidamide
CID 65258329
5-[1-methoxypropan-2-yl(methyl)amino]-2,2-dimethylpentanimidamide
CID 65258029
6-[cyclopropyl(2-methylpropyl)amino]hexan-1-ol
CID 103737780

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide?
The IUPAC name of 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide (CID 65258573) is 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide.
What is the SMILES notation for 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide?
The canonical SMILES for 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide is [H]/N=C(\N)C(C)(C)CCCN(CC(C)C)C1CC1.
What is the InChIKey of 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide?
The InChIKey is ZVHGVBQSKRYDRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-11(2)10-17(12-6-7-12)9-5-8-14(3,4)13(15)16/h11-12H,5-10H2,1-4H3,(H3,15,16).
What are the key properties of 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide?
5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide has a molecular weight of 239.41 g/mol, XLogP of 2.85, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(2-methylpropyl)amino]-2,2-dimethylpentanimidamide is sourced from PubChem (CID 65258573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).