N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine

C14H26N4 — CID 106563002

IUPACN-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine
SMILESCCN1CCC(CNc2nc(C)cn2C(C)C)C1
InChIInChI=1S/C14H26N4/c1-5-17-7-6-13(10-17)8-15-14-16-12(4)9-18(14)11(2)3/h9,11,13H,5-8,10H2,1-4H3,(H,15,16)
InChIKeySJOLOCDSYJSSGF-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.53
Rot. Bonds5

About N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine

N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine (PubChem CID 106563002) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine
PubChem CID106563002
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine
SMILESCCN1CCC(CNc2nc(C)cn2C(C)C)C1
InChIInChI=1S/C14H26N4/c1-5-17-7-6-13(10-17)8-15-14-16-12(4)9-18(14)11(2)3/h9,11,13H,5-8,10H2,1-4H3,(H,15,16)
InChIKeySJOLOCDSYJSSGF-UHFFFAOYSA-N
XLogP2.53
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylpyrrolidin-3-yl)methyl]-2,6-dimethylpyrimidin-4-amine
CID 54939293
4-methyl-1-propan-2-yl-N-(thian-2-ylmethyl)imidazol-2-amine
CID 106577137
N-[(1-ethylpyrrolidin-3-yl)methyl]-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80899426
2-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidine-4-carbonitrile
CID 107543760
1-ethyl-N-[[(3S)-1-ethylpyrrolidin-3-yl]methyl]-3-methylpyrazole-4-sulfonamide
CID 95226625
1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-[(1-ethylpyrrolidin-3-yl)methyl]ethanamine
CID 60856853
N-cyclopentyl-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106554830
N-[(1-ethylpyrrolidin-3-yl)methyl]-6-methyl-1,3-benzothiazol-2-amine
CID 79142498
N-[(1-ethylpyrrolidin-3-yl)methyl]-6-methyl-3-nitropyridin-2-amine
CID 81139026
N-(1-cyclopropylbutan-2-yl)-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106573533
6-N-[(1-ethylpyrrolidin-3-yl)methyl]pyridine-2,6-diamine
CID 80646581
4-chloro-N-[(1-ethylpyrrolidin-3-yl)methyl]-1,3-thiazol-2-amine
CID 83153002

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine?
The IUPAC name of N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine (CID 106563002) is N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine.
What is the SMILES notation for N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine?
The canonical SMILES for N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine is CCN1CCC(CNc2nc(C)cn2C(C)C)C1.
What is the InChIKey of N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine?
The InChIKey is SJOLOCDSYJSSGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-5-17-7-6-13(10-17)8-15-14-16-12(4)9-18(14)11(2)3/h9,11,13H,5-8,10H2,1-4H3,(H,15,16).
What are the key properties of N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine?
N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-3-yl)methyl]-4-methyl-1-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 106563002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).