N'-amino-4-propylcyclohexane-1-carboximidamide

C10H21N3 — CID 77067351

IUPACN'-amino-4-propylcyclohexane-1-carboximidamide
SMILESCCCC1CCC(C(N)=NN)CC1
InChIInChI=1S/C10H21N3/c1-2-3-8-4-6-9(7-5-8)10(11)13-12/h8-9H,2-7,12H2,1H3,(H2,11,13)
InChIKeySXXVKGYOVCFFKH-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.82
Rot. Bonds3

About N'-amino-4-propylcyclohexane-1-carboximidamide

N'-amino-4-propylcyclohexane-1-carboximidamide (PubChem CID 77067351) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N'-amino-4-propylcyclohexane-1-carboximidamide.

Molecular Properties

Compound NameN'-amino-4-propylcyclohexane-1-carboximidamide
PubChem CID77067351
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN'-amino-4-propylcyclohexane-1-carboximidamide
SMILESCCCC1CCC(C(N)=NN)CC1
InChIInChI=1S/C10H21N3/c1-2-3-8-4-6-9(7-5-8)10(11)13-12/h8-9H,2-7,12H2,1H3,(H2,11,13)
InChIKeySXXVKGYOVCFFKH-UHFFFAOYSA-N
XLogP1.82
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide
CID 65402208
N'-(4-propylcyclohexyl)cyclohexanecarboximidamide
CID 63529179
N'-(4-propylcyclohexyl)ethanimidamide
CID 63173139
ethane;propane;propylcyclopropane
CID 145406182
1-butyl-4-[(Z)-3-(4-propylcyclohexyl)but-2-en-2-yl]cyclohexane
CID 173321261
1,4-dipropylcyclohexane;pentane
CID 90867354
1-methyl-4-(4-propylcyclohexyl)cyclohexane
CID 543958
1,3,6-trimethyl-9-propylcycloundecane
CID 123524783
1-methyl-4-[(Z)-4-(4-propylcyclohexyl)pent-3-enyl]cyclohexane
CID 173321092
methyl 4-[2-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]ethyl]cyclohexane-1-carboxylate
CID 70376540
1-propyl-4-[4-(4-propylcyclohexyl)pent-3-enyl]cyclohexane
CID 54061111
4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide
CID 65392128

Frequently Asked Questions

What is the IUPAC name of N'-amino-4-propylcyclohexane-1-carboximidamide?
The IUPAC name of N'-amino-4-propylcyclohexane-1-carboximidamide (CID 77067351) is N'-amino-4-propylcyclohexane-1-carboximidamide.
What is the SMILES notation for N'-amino-4-propylcyclohexane-1-carboximidamide?
The canonical SMILES for N'-amino-4-propylcyclohexane-1-carboximidamide is CCCC1CCC(C(N)=NN)CC1.
What is the InChIKey of N'-amino-4-propylcyclohexane-1-carboximidamide?
The InChIKey is SXXVKGYOVCFFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-2-3-8-4-6-9(7-5-8)10(11)13-12/h8-9H,2-7,12H2,1H3,(H2,11,13).
What are the key properties of N'-amino-4-propylcyclohexane-1-carboximidamide?
N'-amino-4-propylcyclohexane-1-carboximidamide has a molecular weight of 183.30 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-4-propylcyclohexane-1-carboximidamide is sourced from PubChem (CID 77067351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).