N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide

C10H20N2O — CID 63174364

IUPACN'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide
SMILESCOCC(C)/N=C(\N)C1CCCC1
InChIInChI=1S/C10H20N2O/c1-8(7-13-2)12-10(11)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H2,11,12)
InChIKeyYFAXTEROFATPDQ-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.57
Rot. Bonds4

About N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide

N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide (PubChem CID 63174364) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide.

Molecular Properties

Compound NameN'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide
PubChem CID63174364
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide
SMILESCOCC(C)/N=C(\N)C1CCCC1
InChIInChI=1S/C10H20N2O/c1-8(7-13-2)12-10(11)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H2,11,12)
InChIKeyYFAXTEROFATPDQ-UHFFFAOYSA-N
XLogP1.57
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.57
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-methoxypropan-2-yl)cyclopentanecarboximidamide?
The IUPAC name of N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide (CID 63174364) is N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide.
What is the SMILES notation for N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide?
The canonical SMILES for N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide is COCC(C)/N=C(\N)C1CCCC1.
What is the InChIKey of N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide?
The InChIKey is YFAXTEROFATPDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(7-13-2)12-10(11)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H2,11,12).
What are the key properties of N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide?
N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide has a molecular weight of 184.28 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-methoxypropan-2-yl)cyclopentanecarboximidamide is sourced from PubChem (CID 63174364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).