4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine

C12H23N5 — CID 57103016

IUPAC4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine
SMILESCCCNc1cc(N(C)C)nc(NCCC)n1
InChIInChI=1S/C12H23N5/c1-5-7-13-10-9-11(17(3)4)16-12(15-10)14-8-6-2/h9H,5-8H2,1-4H3,(H2,13,14,15,16)
InChIKeyCFMJFOAZNMDGKR-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.19
Rot. Bonds7

About 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine

4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine (PubChem CID 57103016) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine.

Molecular Properties

Compound Name4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine
PubChem CID57103016
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC Name4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine
SMILESCCCNc1cc(N(C)C)nc(NCCC)n1
InChIInChI=1S/C12H23N5/c1-5-7-13-10-9-11(17(3)4)16-12(15-10)14-8-6-2/h9H,5-8H2,1-4H3,(H2,13,14,15,16)
InChIKeyCFMJFOAZNMDGKR-UHFFFAOYSA-N
XLogP2.19
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N,4-N-dimethyl-2-methylsulfanyl-6-N-propylpyrimidine-4,6-diamine
CID 80765397
2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine
CID 80955746
4-N-methoxy-4-N-methyl-2-N-propyl-6-N-prop-2-ynylpyrimidine-2,4,6-triamine;hydrochloride
CID 118432305
N,N-dimethyl-3-[[6-methyl-2-(propylamino)pyrimidin-4-yl]amino]propanamide
CID 80814000
6-N-ethyl-4-N,4-N-dimethyl-2-propylpyrimidine-4,6-diamine
CID 80946313
4-N-[3-(diethylamino)propyl]-6-methyl-2-N-propylpyrimidine-2,4-diamine
CID 80777022
6-N-(2-aminoethyl)-4-N,4-N,2-trimethylpyrimidine-4,6-diamine
CID 99980166
N-[2-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]amino]ethyl]propane-1-sulfonamide
CID 121075570
N,N-dimethyl-2-[[6-methyl-2-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80784037
2-ethyl-4-N-methyl-4-N-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80933924
6-piperidin-1-yl-2-N,4-N-dipropylpyrimidine-2,4-diamine
CID 70171641
4-N-butyl-2-ethyl-4-N-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80933822

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine?
The IUPAC name of 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine (CID 57103016) is 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine.
What is the SMILES notation for 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine?
The canonical SMILES for 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine is CCCNc1cc(N(C)C)nc(NCCC)n1.
What is the InChIKey of 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine?
The InChIKey is CFMJFOAZNMDGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-5-7-13-10-9-11(17(3)4)16-12(15-10)14-8-6-2/h9H,5-8H2,1-4H3,(H2,13,14,15,16).
What are the key properties of 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine?
4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine has a molecular weight of 237.35 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine is sourced from PubChem (CID 57103016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).