N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide

C20H38N4O — CID 19534421

IUPACN-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide
SMILESCCCCCN(CCCCC)CC(C)NC(=O)C(C)n1cc(C)cn1
InChIInChI=1S/C20H38N4O/c1-6-8-10-12-23(13-11-9-7-2)16-18(4)22-20(25)19(5)24-15-17(3)14-21-24/h14-15,18-19H,6-13,16H2,1-5H3,(H,22,25)
InChIKeyUUSYNQRLLPVWSO-UHFFFAOYSA-N
MW350.55 g/mol
LogP3.94
Rot. Bonds13

About N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide

N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide (PubChem CID 19534421) has the molecular formula C20H38N4O and a molecular weight of 350.55 g/mol. Its IUPAC name is N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide
PubChem CID19534421
Molecular FormulaC20H38N4O
Molecular Weight350.55 g/mol
Exact Mass350.30
IUPAC NameN-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide
SMILESCCCCCN(CCCCC)CC(C)NC(=O)C(C)n1cc(C)cn1
InChIInChI=1S/C20H38N4O/c1-6-8-10-12-23(13-11-9-7-2)16-18(4)22-20(25)19(5)24-15-17(3)14-21-24/h14-15,18-19H,6-13,16H2,1-5H3,(H,22,25)
InChIKeyUUSYNQRLLPVWSO-UHFFFAOYSA-N
XLogP3.94
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.55
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-bromopyrazol-1-yl)-N-[1-(dipentylamino)propan-2-yl]butanamide
CID 19551344
3-(4-bromopyrazol-1-yl)-N-[1-(dipentylamino)propan-2-yl]propanamide
CID 19561748
2-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-[1-(dipentylamino)propan-2-yl]propanamide
CID 19539421
N-[1-(dipentylamino)propan-2-yl]-2-ethylpyrazole-3-carboxamide
CID 19475353
ethyl (2R)-2-(4-methylpyrazol-1-yl)propanoate
CID 7017156
2-(difluoromethyl)-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide
CID 19506830
2-(4-methylpyrazol-1-yl)pentan-3-one
CID 64867990
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide
CID 19534375
N-[1-(dipentylamino)propan-2-yl]-3-(5-methyl-4-nitropyrazol-1-yl)propanamide
CID 4772547
N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide
CID 19534343
N-[1-(dipentylamino)propan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414546
N-butyl-2-(4-methylpyrazol-1-yl)-N-(pyridin-3-ylmethyl)propanamide
CID 131929356

Frequently Asked Questions

What is the IUPAC name of N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide (CID 19534421) is N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide is CCCCCN(CCCCC)CC(C)NC(=O)C(C)n1cc(C)cn1.
What is the InChIKey of N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide?
The InChIKey is UUSYNQRLLPVWSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N4O/c1-6-8-10-12-23(13-11-9-7-2)16-18(4)22-20(25)19(5)24-15-17(3)14-21-24/h14-15,18-19H,6-13,16H2,1-5H3,(H,22,25).
What are the key properties of N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide?
N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide has a molecular weight of 350.55 g/mol, XLogP of 3.94, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dipentylamino)propan-2-yl]-2-(4-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 19534421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).