N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine

C15H28N4 — CID 62350659

IUPACN-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine
SMILESCCn1ccnc1CNCC(C)CN1CCCCC1
InChIInChI=1S/C15H28N4/c1-3-19-10-7-17-15(19)12-16-11-14(2)13-18-8-5-4-6-9-18/h7,10,14,16H,3-6,8-9,11-13H2,1-2H3
InChIKeyBTDZJYHKZXUIAL-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.11
Rot. Bonds7

About N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine

N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine (PubChem CID 62350659) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine
PubChem CID62350659
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC NameN-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine
SMILESCCn1ccnc1CNCC(C)CN1CCCCC1
InChIInChI=1S/C15H28N4/c1-3-19-10-7-17-15(19)12-16-11-14(2)13-18-8-5-4-6-9-18/h7,10,14,16H,3-6,8-9,11-13H2,1-2H3
InChIKeyBTDZJYHKZXUIAL-UHFFFAOYSA-N
XLogP2.11
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylpyrrol-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 66443633
N-[(1-ethylimidazol-2-yl)methyl]-2,2-difluoroethanamine
CID 115405976
2-methyl-N-[[1-(3-pyrrolidin-1-ylpropyl)imidazol-2-yl]methyl]propan-1-amine
CID 66400727
1-[(1-ethylimidazol-2-yl)methylamino]-3-methylbutan-2-ol
CID 115641698
1-(azocan-1-yl)-3-[5-[[(1-ethylimidazol-2-yl)methylamino]methyl]-2-methoxyphenoxy]propan-2-ol
CID 45170985
N-[(1-ethylimidazol-2-yl)methyl]propan-1-amine
CID 46784352
2-cyclohexyl-N-[(1-ethylimidazol-2-yl)methyl]ethanamine
CID 55064443
N-[(1-ethylimidazol-2-yl)methyl]-2-(4-methylpiperazin-1-yl)ethanamine
CID 62351528
2-methyl-3-pyrrolidin-1-yl-N-(1,3-thiazol-4-ylmethyl)propan-1-amine
CID 61222270
2-methyl-N-(pyrimidin-5-ylmethyl)-3-pyrrolidin-1-ylpropan-1-amine
CID 62993045
3-[(1-ethylimidazol-2-yl)methylamino]-2-hydroxypropanamide
CID 106171215
N-[(1-ethylimidazol-2-yl)methyl]-2-morpholin-4-ylethanamine
CID 46784360

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine?
The IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine (CID 62350659) is N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine.
What is the SMILES notation for N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine?
The canonical SMILES for N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine is CCn1ccnc1CNCC(C)CN1CCCCC1.
What is the InChIKey of N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine?
The InChIKey is BTDZJYHKZXUIAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-3-19-10-7-17-15(19)12-16-11-14(2)13-18-8-5-4-6-9-18/h7,10,14,16H,3-6,8-9,11-13H2,1-2H3.
What are the key properties of N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine?
N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine has a molecular weight of 264.42 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylimidazol-2-yl)methyl]-2-methyl-3-piperidin-1-ylpropan-1-amine is sourced from PubChem (CID 62350659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).