N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide

C10H15ClN4O — CID 56903276

IUPACN-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide
SMILESN[C@@H]1CC[C@@H]1NC(=O)CCn1cc(Cl)cn1
InChIInChI=1S/C10H15ClN4O/c11-7-5-13-15(6-7)4-3-10(16)14-9-2-1-8(9)12/h5-6,8-9H,1-4,12H2,(H,14,16)/t8-,9+/m1/s1
InChIKeyCZWNLNHYMPJJPI-BDAKNGLRSA-N
MW242.71 g/mol
LogP0.53
Rot. Bonds4

About N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide

N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide (PubChem CID 56903276) has the molecular formula C10H15ClN4O and a molecular weight of 242.71 g/mol. Its IUPAC name is N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide
PubChem CID56903276
Molecular FormulaC10H15ClN4O
Molecular Weight242.71 g/mol
Exact Mass242.09
IUPAC NameN-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide
SMILESN[C@@H]1CC[C@@H]1NC(=O)CCn1cc(Cl)cn1
InChIInChI=1S/C10H15ClN4O/c11-7-5-13-15(6-7)4-3-10(16)14-9-2-1-8(9)12/h5-6,8-9H,1-4,12H2,(H,14,16)/t8-,9+/m1/s1
InChIKeyCZWNLNHYMPJJPI-BDAKNGLRSA-N
XLogP0.53
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(4-chloro-1H-pyrazol-1-yl)propanoyl]azepan-3-amine
CID 70719252
3-[1-(4-methylpyrazol-1-yl)propan-2-ylamino]-N-propan-2-ylpropanamide
CID 53595702
3-[2-(4-methylpyrazol-1-yl)ethylamino]-N-propan-2-ylpropanamide
CID 72142047
(2S)-1-[3-(4-chloropyrazol-1-yl)propanoyl]-N-cyclopropylpiperazine-2-carboxamide
CID 95707097
(2S)-2-(4-chloropyrazol-1-yl)-N-[2-[ethyl(methyl)amino]-2-methylpropyl]propanamide
CID 125161578
2-(4-chloropyrazol-1-yl)-N-(3,4,4-trifluorobut-3-enyl)acetamide
CID 163220331
N-[2-(4-chloropyrazol-1-yl)ethyl]-2,2,2-trifluoroacetamide
CID 19283453
N-[2-(4-chloropyrazol-1-yl)ethyl]-2,2,3,3,4,4,4-heptafluorobutanamide
CID 19283458
N-[3-(4-chloropyrazol-1-yl)propyl]-2,2,2-trifluoroacetamide
CID 19330317
N-[3-(4-chloropyrazol-1-yl)propyl]-2,2,3,3,4,4,4-heptafluorobutanamide
CID 19330318
N-[3-(4-chloro-1H-pyrazol-1-yl)propyl]-4,4,4-trifluorobutanamide
CID 91795195
3-(4-chloropyrazol-1-yl)-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)propanamide;hydrochloride
CID 120812452

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide?
The IUPAC name of N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide (CID 56903276) is N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide.
What is the SMILES notation for N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide?
The canonical SMILES for N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide is N[C@@H]1CC[C@@H]1NC(=O)CCn1cc(Cl)cn1.
What is the InChIKey of N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide?
The InChIKey is CZWNLNHYMPJJPI-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H15ClN4O/c11-7-5-13-15(6-7)4-3-10(16)14-9-2-1-8(9)12/h5-6,8-9H,1-4,12H2,(H,14,16)/t8-,9+/m1/s1.
What are the key properties of N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide?
N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide has a molecular weight of 242.71 g/mol, XLogP of 0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2R)-2-aminocyclobutyl]-3-(4-chloropyrazol-1-yl)propanamide is sourced from PubChem (CID 56903276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).