N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine

C14H24N4 — CID 141341274

IUPACN-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine
SMILESCCCc1cc(N2CCC(NC(C)C)C2)ncn1
InChIInChI=1S/C14H24N4/c1-4-5-12-8-14(16-10-15-12)18-7-6-13(9-18)17-11(2)3/h8,10-11,13,17H,4-7,9H2,1-3H3
InChIKeyCARPSBFQOXFVSK-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.01
Rot. Bonds5

About N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine

N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine (PubChem CID 141341274) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine
PubChem CID141341274
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine
SMILESCCCc1cc(N2CCC(NC(C)C)C2)ncn1
InChIInChI=1S/C14H24N4/c1-4-5-12-8-14(16-10-15-12)18-7-6-13(9-18)17-11(2)3/h8,10-11,13,17H,4-7,9H2,1-3H3
InChIKeyCARPSBFQOXFVSK-UHFFFAOYSA-N
XLogP2.01
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(6-propylpyrimidin-4-yl)piperidin-3-yl]methyl]cyclopropanamine
CID 62586350
1-(6-ethylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 62545846
4-[3-(2-bromoethyl)piperidin-1-yl]-6-propylpyrimidine
CID 80679760
N-[(2S)-butan-2-yl]-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine
CID 69150898
N-methyl-1-[1-(6-propylpyrimidin-4-yl)piperidin-2-yl]ethanamine
CID 63854574
1-(1-methylpyrazol-3-yl)-N-propan-2-ylpyrrolidin-3-amine
CID 79786962
[1-(6-propylpyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 61409380
4-(4-bromo-3-methylpiperidin-1-yl)-6-ethylpyrimidine
CID 114682855
[4-methyl-1-(6-propylpyrimidin-4-yl)piperazin-2-yl]methanamine
CID 80506382
N-[(3S)-1-(6-ethylpyrimidin-4-yl)piperidin-3-yl]-5-propan-2-yl-1H-pyrazole-4-carboxamide
CID 124626387
N-[1-(6-ethylpyrimidin-4-yl)piperidin-3-yl]-2-(methylamino)acetamide;hydrochloride
CID 120704514
N-[[4-(6-propylpyrimidin-4-yl)morpholin-3-yl]methyl]propan-2-amine
CID 83104201

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine?
The IUPAC name of N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine (CID 141341274) is N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine.
What is the SMILES notation for N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine?
The canonical SMILES for N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine is CCCc1cc(N2CCC(NC(C)C)C2)ncn1.
What is the InChIKey of N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine?
The InChIKey is CARPSBFQOXFVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-4-5-12-8-14(16-10-15-12)18-7-6-13(9-18)17-11(2)3/h8,10-11,13,17H,4-7,9H2,1-3H3.
What are the key properties of N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine?
N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine has a molecular weight of 248.37 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-amine is sourced from PubChem (CID 141341274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).