6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine

C15H26N4O — CID 106641292

IUPAC6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
SMILESCCOc1cc(N(CC2CCCCN2)C(C)C)ncn1
InChIInChI=1S/C15H26N4O/c1-4-20-15-9-14(17-11-18-15)19(12(2)3)10-13-7-5-6-8-16-13/h9,11-13,16H,4-8,10H2,1-3H3
InChIKeyKTOOPUILGFTLLH-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.23
Rot. Bonds6

About 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine

6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine (PubChem CID 106641292) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
PubChem CID106641292
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
SMILESCCOc1cc(N(CC2CCCCN2)C(C)C)ncn1
InChIInChI=1S/C15H26N4O/c1-4-20-15-9-14(17-11-18-15)19(12(2)3)10-13-7-5-6-8-16-13/h9,11-13,16H,4-8,10H2,1-3H3
InChIKeyKTOOPUILGFTLLH-UHFFFAOYSA-N
XLogP2.23
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(piperidin-2-ylmethyl)-N-propan-2-yl-6-propan-2-yloxypyrimidin-4-amine
CID 106641351
6-ethoxy-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106620572
4-ethoxy-6-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-2-amine
CID 106641392
N-ethyl-6-propan-2-yloxy-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106619278
N-(2-methylpropyl)-6-propoxy-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106620729
N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrido[2,3-b]pyrazin-6-amine
CID 106641355
6-ethoxy-2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106620544
6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106619805
2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]pyridine-4-carboxamide
CID 106618863
N-(piperidin-2-ylmethyl)-N-propan-2-ylthieno[3,2-d]pyrimidin-4-amine
CID 106641515
5-chloro-3-fluoro-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 106641533
6-ethoxy-N-methyl-N-piperidin-3-ylpyrimidin-4-amine
CID 66319466

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine (CID 106641292) is 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine is CCOc1cc(N(CC2CCCCN2)C(C)C)ncn1.
What is the InChIKey of 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is KTOOPUILGFTLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-20-15-9-14(17-11-18-15)19(12(2)3)10-13-7-5-6-8-16-13/h9,11-13,16H,4-8,10H2,1-3H3.
What are the key properties of 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 106641292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).