N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide

C17H33N3O — CID 106974576

IUPACN-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)C2CCN(C(C)C)CC2)CCCN1
InChIInChI=1S/C17H33N3O/c1-5-9-17(10-6-11-18-17)16(21)19(4)15-7-12-20(13-8-15)14(2)3/h14-15,18H,5-13H2,1-4H3
InChIKeyRZFADJNAROEWEE-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.24
Rot. Bonds5

About N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide

N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide (PubChem CID 106974576) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide
PubChem CID106974576
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC NameN-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)C2CCN(C(C)C)CC2)CCCN1
InChIInChI=1S/C17H33N3O/c1-5-9-17(10-6-11-18-17)16(21)19(4)15-7-12-20(13-8-15)14(2)3/h14-15,18H,5-13H2,1-4H3
InChIKeyRZFADJNAROEWEE-UHFFFAOYSA-N
XLogP2.24
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(3-methylcyclohexyl)-2-propylpyrrolidine-2-carboxamide
CID 106974976
N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide
CID 83080870
N-methyl-N-(1-methylsulfanylpropan-2-yl)-2-propylpyrrolidine-2-carboxamide
CID 106975714
N,N-bis(2-methylpropyl)-2-propylpyrrolidine-2-carboxamide
CID 106974292
2-[cyclopropyl-(2-propylpyrrolidine-2-carbonyl)amino]acetic acid
CID 106974836
N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide
CID 106974598
N-propan-2-yl-N,2-dipropylpyrrolidine-2-carboxamide
CID 106974202
[3-(dimethylamino)piperidin-1-yl]-(2-propylpyrrolidin-2-yl)methanone
CID 106975402
cyclopentyl-(2-propylpyrrolidin-2-yl)methanone
CID 106976587
2-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine-2-carboxylic acid
CID 115103561
N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974973
N-(1-cyclopropylethyl)-2-propyl-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 106974581

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide (CID 106974576) is N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)N(C)C2CCN(C(C)C)CC2)CCCN1.
What is the InChIKey of N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide?
The InChIKey is RZFADJNAROEWEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-5-9-17(10-6-11-18-17)16(21)19(4)15-7-12-20(13-8-15)14(2)3/h14-15,18H,5-13H2,1-4H3.
What are the key properties of N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide?
N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide has a molecular weight of 295.47 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106974576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).