5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine

C15H25N3 — CID 76985888

IUPAC5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine
SMILESCCCNC1NNC(c2ccccc2)C1C(C)C
InChIInChI=1S/C15H25N3/c1-4-10-16-15-13(11(2)3)14(17-18-15)12-8-6-5-7-9-12/h5-9,11,13-18H,4,10H2,1-3H3
InChIKeyNAPYWKRWJRPCDA-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.43
Rot. Bonds5

About 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine

5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine (PubChem CID 76985888) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine.

Molecular Properties

Compound Name5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine
PubChem CID76985888
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine
SMILESCCCNC1NNC(c2ccccc2)C1C(C)C
InChIInChI=1S/C15H25N3/c1-4-10-16-15-13(11(2)3)14(17-18-15)12-8-6-5-7-9-12/h5-9,11,13-18H,4,10H2,1-3H3
InChIKeyNAPYWKRWJRPCDA-UHFFFAOYSA-N
XLogP2.43
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,4R)-4-phenyl-3-(propylamino)azetidin-2-one
CID 118328038
5-(4-ethylphenyl)-4-methyl-N-propylpyrazolidin-3-amine
CID 76985736
(1S,3S)-3-phenyl-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 101018229
N-ethyl-3-phenyl-2-propan-2-ylcyclobutan-1-amine
CID 81421340
N,2,2-triethyl-3-phenyl-4-propan-2-ylcyclobutan-1-amine
CID 81421361
3,6-diphenyl-1,2,3,3a,4,5,6,6a-octahydropyrazolo[4,3-c]pyrazole
CID 45036955
2-phenyl-N-propylcyclohexan-1-amine
CID 43755016
2-methyl-3-phenyl-N-propylcyclobutan-1-amine
CID 81417285
4-phenyl-2-propan-2-ylsulfanyl-N-propylcyclohexan-1-amine
CID 64633246
2-phenyl-3-propan-2-ylazetidine
CID 66350091
2-ethyl-2-methyl-3-phenyl-N-propylcyclobutan-1-amine
CID 81417330
2-(1-phenylethoxy)-N-propylcyclopentan-1-amine
CID 55036153

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine?
The IUPAC name of 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine (CID 76985888) is 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine.
What is the SMILES notation for 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine?
The canonical SMILES for 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine is CCCNC1NNC(c2ccccc2)C1C(C)C.
What is the InChIKey of 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine?
The InChIKey is NAPYWKRWJRPCDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-10-16-15-13(11(2)3)14(17-18-15)12-8-6-5-7-9-12/h5-9,11,13-18H,4,10H2,1-3H3.
What are the key properties of 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine?
5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine has a molecular weight of 247.39 g/mol, XLogP of 2.43, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-4-propan-2-yl-N-propylpyrazolidin-3-amine is sourced from PubChem (CID 76985888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).