N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine

C14H21N5O — CID 106567620

IUPACN-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine
SMILESCOCCn1cc(-n2ccnc2NC2CCCC2)cn1
InChIInChI=1S/C14H21N5O/c1-20-9-8-18-11-13(10-16-18)19-7-6-15-14(19)17-12-4-2-3-5-12/h6-7,10-12H,2-5,8-9H2,1H3,(H,15,17)
InChIKeyPWEPTUKLRXNIPQ-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.07
Rot. Bonds6

About N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine

N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine (PubChem CID 106567620) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine
PubChem CID106567620
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine
SMILESCOCCn1cc(-n2ccnc2NC2CCCC2)cn1
InChIInChI=1S/C14H21N5O/c1-20-9-8-18-11-13(10-16-18)19-7-6-15-14(19)17-12-4-2-3-5-12/h6-7,10-12H,2-5,8-9H2,1H3,(H,15,17)
InChIKeyPWEPTUKLRXNIPQ-UHFFFAOYSA-N
XLogP2.07
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine (CID 106567620) is N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine is COCCn1cc(-n2ccnc2NC2CCCC2)cn1.
What is the InChIKey of N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine?
The InChIKey is PWEPTUKLRXNIPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-20-9-8-18-11-13(10-16-18)19-7-6-15-14(19)17-12-4-2-3-5-12/h6-7,10-12H,2-5,8-9H2,1H3,(H,15,17).
What are the key properties of N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine?
N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine has a molecular weight of 275.36 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine is sourced from PubChem (CID 106567620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).