5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine

C14H18N4O — CID 63208632

IUPAC5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine
SMILESCc1cnc(NCc2cccnc2OC(C)C)nc1
InChIInChI=1S/C14H18N4O/c1-10(2)19-13-12(5-4-6-15-13)9-18-14-16-7-11(3)8-17-14/h4-8,10H,9H2,1-3H3,(H,16,17,18)
InChIKeyCEXWFAVBXAUSRA-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.58
Rot. Bonds5

About 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine

5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine (PubChem CID 63208632) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine
PubChem CID63208632
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine
SMILESCc1cnc(NCc2cccnc2OC(C)C)nc1
InChIInChI=1S/C14H18N4O/c1-10(2)19-13-12(5-4-6-15-13)9-18-14-16-7-11(3)8-17-14/h4-8,10H,9H2,1-3H3,(H,16,17,18)
InChIKeyCEXWFAVBXAUSRA-UHFFFAOYSA-N
XLogP2.58
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine
CID 115586120
5-iodo-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-4-amine
CID 66342116
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61373670
4-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3,4-diamine
CID 61373121
4,5-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1,3-thiazol-2-amine
CID 65169702
5-[(2-propan-2-yloxy-3-pyridinyl)methylamino]pyridine-2-carbonitrile
CID 79839394
5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-4-amine
CID 105369277
6-methyl-2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]pyrimidine-4-carbonitrile
CID 107552003
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propan-1-amine
CID 61373669
N-[(2-methyl-1H-imidazol-5-yl)methyl]-1-(2-propan-2-yloxy-3-pyridinyl)methanamine
CID 62742368
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]prop-2-yn-1-amine
CID 62142011
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopropanamine
CID 62290526

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine?
The IUPAC name of 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine (CID 63208632) is 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine.
What is the SMILES notation for 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine?
The canonical SMILES for 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine is Cc1cnc(NCc2cccnc2OC(C)C)nc1.
What is the InChIKey of 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine?
The InChIKey is CEXWFAVBXAUSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10(2)19-13-12(5-4-6-15-13)9-18-14-16-7-11(3)8-17-14/h4-8,10H,9H2,1-3H3,(H,16,17,18).
What are the key properties of 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine?
5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine has a molecular weight of 258.32 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 63208632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).