5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide

C15H29N5O — CID 104684262

IUPAC5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide
SMILESCCN(CC)CCn1cc(NC(=O)C(C)CCCN)cn1
InChIInChI=1S/C15H29N5O/c1-4-19(5-2)9-10-20-12-14(11-17-20)18-15(21)13(3)7-6-8-16/h11-13H,4-10,16H2,1-3H3,(H,18,21)
InChIKeyLRRHXADHTRCDJC-UHFFFAOYSA-N
MW295.43 g/mol
LogP1.54
Rot. Bonds10

About 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide

5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide (PubChem CID 104684262) has the molecular formula C15H29N5O and a molecular weight of 295.43 g/mol. Its IUPAC name is 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide
PubChem CID104684262
Molecular FormulaC15H29N5O
Molecular Weight295.43 g/mol
Exact Mass295.24
IUPAC Name5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide
SMILESCCN(CC)CCn1cc(NC(=O)C(C)CCCN)cn1
InChIInChI=1S/C15H29N5O/c1-4-19(5-2)9-10-20-12-14(11-17-20)18-15(21)13(3)7-6-8-16/h11-13H,4-10,16H2,1-3H3,(H,18,21)
InChIKeyLRRHXADHTRCDJC-UHFFFAOYSA-N
XLogP1.54
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-(methylamino)propanamide
CID 62638227
5-amino-N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-2-methylpentanamide
CID 104683948
3-(aminomethyl)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]pentanamide
CID 81071014
2-chloro-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]acetamide
CID 54867250
N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]butanamide
CID 47927357
methyl 2-[[1-[2-(diethylamino)ethyl]pyrazol-4-yl]amino]propanoate
CID 66172738
N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methoxy-2-phenylacetamide
CID 60587081
1-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]cyclopentane-1-carboxamide
CID 60945429
1-[2-(diethylamino)ethyl]-N-(3-methylbutan-2-yl)pyrazol-4-amine
CID 54866652
6-amino-N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-2-methylheptanamide
CID 65290605
2-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]cyclopentane-1-carboxamide
CID 64823183
2-bromo-N-[1-[[1-[2-(diethylamino)ethyl]pyrazol-4-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide
CID 55836296

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide?
The IUPAC name of 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide (CID 104684262) is 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide.
What is the SMILES notation for 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide?
The canonical SMILES for 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide is CCN(CC)CCn1cc(NC(=O)C(C)CCCN)cn1.
What is the InChIKey of 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide?
The InChIKey is LRRHXADHTRCDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5O/c1-4-19(5-2)9-10-20-12-14(11-17-20)18-15(21)13(3)7-6-8-16/h11-13H,4-10,16H2,1-3H3,(H,18,21).
What are the key properties of 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide?
5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide has a molecular weight of 295.43 g/mol, XLogP of 1.54, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]-2-methylpentanamide is sourced from PubChem (CID 104684262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).