N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide

C10H21N3 — CID 63177998

IUPACN'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide
SMILESCC(CCN(C)C)/N=C(\N)C1CC1
InChIInChI=1S/C10H21N3/c1-8(6-7-13(2)3)12-10(11)9-4-5-9/h8-9H,4-7H2,1-3H3,(H2,11,12)
InChIKeyGFTRNXFTDBITKS-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.09
Rot. Bonds5

About N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide

N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide (PubChem CID 63177998) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide
PubChem CID63177998
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide
SMILESCC(CCN(C)C)/N=C(\N)C1CC1
InChIInChI=1S/C10H21N3/c1-8(6-7-13(2)3)12-10(11)9-4-5-9/h8-9H,4-7H2,1-3H3,(H2,11,12)
InChIKeyGFTRNXFTDBITKS-UHFFFAOYSA-N
XLogP1.09
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.09
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'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide?
The IUPAC name of N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide (CID 63177998) is N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide.
What is the SMILES notation for N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide?
The canonical SMILES for N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide is CC(CCN(C)C)/N=C(\N)C1CC1.
What is the InChIKey of N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide?
The InChIKey is GFTRNXFTDBITKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-8(6-7-13(2)3)12-10(11)9-4-5-9/h8-9H,4-7H2,1-3H3,(H2,11,12).
What are the key properties of N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide?
N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide has a molecular weight of 183.30 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(dimethylamino)butan-2-yl]cyclopropanecarboximidamide is sourced from PubChem (CID 63177998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).