N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide

C11H23N3 — CID 63177673

IUPACN'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide
SMILESCCN(CC)CC(C)/N=C(\N)C1CC1
InChIInChI=1S/C11H23N3/c1-4-14(5-2)8-9(3)13-11(12)10-6-7-10/h9-10H,4-8H2,1-3H3,(H2,12,13)
InChIKeyCEYFGYFRBWYFPE-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.48
Rot. Bonds6

About N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide

N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide (PubChem CID 63177673) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide
PubChem CID63177673
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide
SMILESCCN(CC)CC(C)/N=C(\N)C1CC1
InChIInChI=1S/C11H23N3/c1-4-14(5-2)8-9(3)13-11(12)10-6-7-10/h9-10H,4-8H2,1-3H3,(H2,12,13)
InChIKeyCEYFGYFRBWYFPE-UHFFFAOYSA-N
XLogP1.48
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.48
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide?
The IUPAC name of N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide (CID 63177673) is N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide.
What is the SMILES notation for N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide?
The canonical SMILES for N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide is CCN(CC)CC(C)/N=C(\N)C1CC1.
What is the InChIKey of N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide?
The InChIKey is CEYFGYFRBWYFPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-4-14(5-2)8-9(3)13-11(12)10-6-7-10/h9-10H,4-8H2,1-3H3,(H2,12,13).
What are the key properties of N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide?
N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide has a molecular weight of 197.33 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(diethylamino)propan-2-yl]cyclopropanecarboximidamide is sourced from PubChem (CID 63177673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).