1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine

C14H26N4 — CID 79719989

IUPAC1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine
SMILESCCn1ccnc1N(CC1CCNCC1)C(C)C
InChIInChI=1S/C14H26N4/c1-4-17-10-9-16-14(17)18(12(2)3)11-13-5-7-15-8-6-13/h9-10,12-13,15H,4-8,11H2,1-3H3
InChIKeyXSRCCHHDUHABSF-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.12
Rot. Bonds5

About 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine

1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine (PubChem CID 79719989) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine
PubChem CID79719989
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine
SMILESCCn1ccnc1N(CC1CCNCC1)C(C)C
InChIInChI=1S/C14H26N4/c1-4-17-10-9-16-14(17)18(12(2)3)11-13-5-7-15-8-6-13/h9-10,12-13,15H,4-8,11H2,1-3H3
InChIKeyXSRCCHHDUHABSF-UHFFFAOYSA-N
XLogP2.12
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 ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
CID 79720132
N-(2-chloroethyl)-1-ethyl-N-propan-2-ylimidazol-2-amine
CID 63392355
1-ethyl-3-[ethyl(piperidin-4-ylmethyl)amino]pyrazin-2-one
CID 79719452
3,5-difluoro-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 112676220
N-(cyclopropylmethyl)-1-ethyl-N-(pyrrolidin-2-ylmethyl)imidazol-2-amine
CID 106619952
1-(3-methoxypropyl)-N-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
CID 106553025
5-methoxy-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 106504475
6-[piperidin-4-ylmethyl(propan-2-yl)amino]pyridine-3-carbonitrile
CID 79719998
1,4-diethyl-N-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
CID 106553023
6-ethoxy-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 79719565
3-[ethyl(piperidin-4-ylmethyl)amino]-1-propan-2-ylpyrazin-2-one
CID 79719529
4-[piperidin-4-ylmethyl(propan-2-yl)amino]pyridine-2-carbonitrile
CID 79719702

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine?
The IUPAC name of 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine (CID 79719989) is 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine.
What is the SMILES notation for 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine?
The canonical SMILES for 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine is CCn1ccnc1N(CC1CCNCC1)C(C)C.
What is the InChIKey of 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine?
The InChIKey is XSRCCHHDUHABSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-4-17-10-9-16-14(17)18(12(2)3)11-13-5-7-15-8-6-13/h9-10,12-13,15H,4-8,11H2,1-3H3.
What are the key properties of 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine?
1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 79719989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).